metal-organic compounds
Bis[1,3-bis(diphenylphosphino)propane-κ2P:P′]silver(I) bis(chlorodifluoroacetato-κO)triphenylstannate(IV)
aDepartment of Chemistry, University of Malaya, 50603 Kuala Lumpur, Malaysia
*Correspondence e-mail: seikweng@um.edu.my
In the title salt, [Ag(C27H26P2)2][Sn(C6H5)3(C2ClF2O2)], the AgI atom exists in a tetrahedral coordination geometry formed by four P atoms [Ag—P = 2.460 (1)–2.501 (1) Å], whereas the SnIV atom exists in a trans-trigonal–bipyramidal coordination geometry formed by two O [Sn—O = 2.208 (3) and 2.233 (3) Å] and three C atoms [Sn—C = 2.115 (4)–2.128 (4) Å;(Σ C—Sn—C)= 360.0 (6)°].
Related literature
For the crystal structures of other bis(chlorodifluoroacetato)triorganostannates, see: Ng & Hook (1999); Teo et al. (2004, 2007, 2008). The structural chemistry of organotin carboxylates has been reviewed by Tiekink (1991, 1994).
Experimental
Crystal data
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Data collection: APEX2 (Bruker, 2007); cell SAINT (Bruker, 2007); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: X-SEED (Barbour, 2001); software used to prepare material for publication: publCIF (Westrip, 2008).
Supporting information
10.1107/S1600536808010763/cv2399sup1.cif
contains datablocks global, I. DOI:Structure factors: contains datablock I. DOI: 10.1107/S1600536808010763/cv2399Isup2.hkl
Triphenyltin hydroxide (0.18 g, 0.5 mmol) and chorodifluoroacetic acid (0.05 ml, 0.5 mmol) were dissolved in dichloromethane/methanol (25 ml). The mixture was heated until the hydroxide dissolved completely. Another solution containing 1,3-bis(diphenylphosphino)propane (0.41 g, 1.0 mmol) and silver trifluoroacetate (0.11 g, 0.5 mmol) was prepared; this was also heated until the reagents dissolved completely. The two solutions were mixed; crystals were obtained by allowing the solvent to evaporate in about 70% yield.
Carbon-bound H-atoms were placed in calculated positions (C—H 0.95 to 0.99 Å) and were included in the
in the riding model approximation, with U(H) set to 1.2Ueq(C).One of the phenyl rings shows large displacement ellipsoids. This ring, C44-C49, was restrained to be nearly planar; the bonded C-atoms were restrained to 1.39 (1) Å and 1,4-related ones to 2.78 (1) Å. The anisotropic displacement parameters of atoms C44-C49 were restrained to be nearly isotropic.
Data collection: APEX2 (Bruker, 2007); cell
SAINT (Bruker, 2007); data reduction: SAINT (Bruker, 2007); program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: X-SEED (Barbour, 2001); software used to prepare material for publication: publCIF (Westrip, 2008).Fig. 1. The 70% probability displacement ellipsoids plot (Barbour, 2001) of (I). Hydrogen atoms are drawn as spheres of arbitrary radii. |
[Ag(C27H26P2)2][Sn(C6H5)3(C2ClF2O2)] | Z = 2 |
Mr = 1541.64 | F(000) = 1564 |
Triclinic, P1 | Dx = 1.490 Mg m−3 |
Hall symbol: -P 1 | Mo Kα radiation, λ = 0.71073 Å |
a = 10.5554 (2) Å | Cell parameters from 4777 reflections |
b = 17.6600 (4) Å | θ = 2.2–24° |
c = 19.1383 (4) Å | µ = 0.88 mm−1 |
α = 91.581 (1)° | T = 100 K |
β = 94.931 (1)° | Block, colourless |
γ = 104.535 (1)° | 0.18 × 0.12 × 0.05 mm |
V = 3436.1 (1) Å3 |
Bruker SMART APEX diffractometer | 15398 independent reflections |
Radiation source: fine-focus sealed tube | 10993 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.065 |
ω scans | θmax = 27.5°, θmin = 1.1° |
Absorption correction: multi-scan (SADABS; Sheldrick, 1996) | h = −13→13 |
Tmin = 0.858, Tmax = 0.957 | k = −22→18 |
35712 measured reflections | l = −24→24 |
Refinement on F2 | Primary atom site location: structure-invariant direct methods |
Least-squares matrix: full | Secondary atom site location: difference Fourier map |
R[F2 > 2σ(F2)] = 0.049 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.112 | H-atom parameters constrained |
S = 1.05 | w = 1/[σ2(Fo2) + 1.3097P] where P = (Fo2 + 2Fc2)/3 |
15398 reflections | (Δ/σ)max = 0.001 |
829 parameters | Δρmax = 0.86 e Å−3 |
48 restraints | Δρmin = −0.76 e Å−3 |
[Ag(C27H26P2)2][Sn(C6H5)3(C2ClF2O2)] | γ = 104.535 (1)° |
Mr = 1541.64 | V = 3436.1 (1) Å3 |
Triclinic, P1 | Z = 2 |
a = 10.5554 (2) Å | Mo Kα radiation |
b = 17.6600 (4) Å | µ = 0.88 mm−1 |
c = 19.1383 (4) Å | T = 100 K |
α = 91.581 (1)° | 0.18 × 0.12 × 0.05 mm |
β = 94.931 (1)° |
Bruker SMART APEX diffractometer | 15398 independent reflections |
Absorption correction: multi-scan (SADABS; Sheldrick, 1996) | 10993 reflections with I > 2σ(I) |
Tmin = 0.858, Tmax = 0.957 | Rint = 0.065 |
35712 measured reflections |
R[F2 > 2σ(F2)] = 0.049 | 48 restraints |
wR(F2) = 0.112 | H-atom parameters constrained |
S = 1.05 | Δρmax = 0.86 e Å−3 |
15398 reflections | Δρmin = −0.76 e Å−3 |
829 parameters |
x | y | z | Uiso*/Ueq | ||
Sn1 | 0.02753 (3) | 0.730942 (18) | 0.273935 (14) | 0.01420 (8) | |
Ag1 | 0.41787 (3) | 0.227571 (19) | 0.254989 (15) | 0.01370 (8) | |
Cl1 | −0.23532 (11) | 0.56238 (7) | 0.09181 (6) | 0.0289 (3) | |
Cl2 | 0.08334 (11) | 0.88104 (8) | 0.50499 (6) | 0.0294 (3) | |
P1 | 0.21513 (10) | 0.14129 (7) | 0.19532 (5) | 0.0140 (2) | |
P2 | 0.30050 (10) | 0.27516 (7) | 0.34838 (5) | 0.0164 (2) | |
P3 | 0.56274 (10) | 0.32427 (7) | 0.18763 (6) | 0.0154 (2) | |
P4 | 0.59289 (10) | 0.17736 (7) | 0.31680 (6) | 0.0153 (2) | |
F1 | −0.0366 (3) | 0.56467 (16) | 0.02666 (12) | 0.0289 (6) | |
F2 | −0.0553 (3) | 0.49132 (16) | 0.11555 (13) | 0.0301 (6) | |
F3 | −0.1207 (3) | 0.92144 (19) | 0.46015 (14) | 0.0399 (8) | |
F4 | 0.0540 (3) | 0.97475 (16) | 0.41018 (14) | 0.0335 (7) | |
O1 | −0.0013 (3) | 0.62288 (17) | 0.20477 (14) | 0.0173 (6) | |
O2 | 0.0963 (3) | 0.68053 (19) | 0.11296 (15) | 0.0253 (7) | |
O3 | 0.0474 (3) | 0.83204 (18) | 0.34826 (14) | 0.0202 (7) | |
O4 | −0.1681 (3) | 0.8079 (2) | 0.36239 (16) | 0.0278 (8) | |
C1 | −0.0392 (4) | 0.6519 (3) | 0.3528 (2) | 0.0168 (9) | |
C2 | −0.1432 (4) | 0.5862 (3) | 0.3396 (2) | 0.0245 (10) | |
H2 | −0.1891 | 0.5759 | 0.2940 | 0.029* | |
C3 | −0.1815 (4) | 0.5347 (3) | 0.3923 (2) | 0.0291 (11) | |
H3 | −0.2541 | 0.4902 | 0.3829 | 0.035* | |
C4 | −0.1132 (5) | 0.5486 (3) | 0.4585 (2) | 0.0265 (11) | |
H4 | −0.1382 | 0.5136 | 0.4947 | 0.032* | |
C5 | −0.0085 (5) | 0.6138 (3) | 0.4714 (2) | 0.0277 (11) | |
H5 | 0.0394 | 0.6232 | 0.5164 | 0.033* | |
C6 | 0.0270 (4) | 0.6650 (3) | 0.4197 (2) | 0.0237 (10) | |
H6 | 0.0982 | 0.7101 | 0.4297 | 0.028* | |
C7 | 0.2352 (4) | 0.7673 (3) | 0.2721 (2) | 0.0147 (9) | |
C8 | 0.3074 (4) | 0.7132 (3) | 0.2625 (2) | 0.0228 (10) | |
H8 | 0.2638 | 0.6592 | 0.2548 | 0.027* | |
C9 | 0.4436 (4) | 0.7373 (3) | 0.2641 (2) | 0.0243 (10) | |
H9 | 0.4927 | 0.6994 | 0.2599 | 0.029* | |
C10 | 0.5081 (4) | 0.8157 (3) | 0.2717 (2) | 0.0223 (10) | |
H10 | 0.6009 | 0.8319 | 0.2714 | 0.027* | |
C11 | 0.4365 (4) | 0.8706 (3) | 0.2799 (2) | 0.0211 (10) | |
H11 | 0.4795 | 0.9249 | 0.2843 | 0.025* | |
C12 | 0.3011 (4) | 0.8455 (3) | 0.2815 (2) | 0.0185 (9) | |
H12 | 0.2526 | 0.8831 | 0.2893 | 0.022* | |
C13 | −0.0893 (4) | 0.7739 (3) | 0.1972 (2) | 0.0152 (9) | |
C14 | −0.2241 (4) | 0.7448 (3) | 0.1842 (2) | 0.0241 (10) | |
H14 | −0.2683 | 0.7057 | 0.2130 | 0.029* | |
C15 | −0.2964 (4) | 0.7710 (3) | 0.1308 (2) | 0.0263 (11) | |
H15 | −0.3890 | 0.7504 | 0.1236 | 0.032* | |
C16 | −0.2335 (4) | 0.8270 (3) | 0.0883 (2) | 0.0286 (12) | |
H16 | −0.2824 | 0.8442 | 0.0507 | 0.034* | |
C17 | −0.0999 (5) | 0.8582 (3) | 0.1001 (2) | 0.0344 (13) | |
H17 | −0.0568 | 0.8977 | 0.0712 | 0.041* | |
C18 | −0.0276 (4) | 0.8320 (3) | 0.1543 (2) | 0.0277 (11) | |
H18 | 0.0646 | 0.8538 | 0.1622 | 0.033* | |
C19 | 0.0206 (4) | 0.6297 (3) | 0.1401 (2) | 0.0171 (9) | |
C20 | −0.0680 (4) | 0.5614 (3) | 0.0928 (2) | 0.0212 (10) | |
C21 | −0.0532 (4) | 0.8413 (3) | 0.3756 (2) | 0.0185 (9) | |
C22 | −0.0145 (4) | 0.9070 (3) | 0.4342 (2) | 0.0228 (10) | |
C23 | 0.1159 (4) | 0.1904 (3) | 0.1391 (2) | 0.0155 (9) | |
C24 | 0.1817 (4) | 0.2448 (3) | 0.0947 (2) | 0.0197 (10) | |
H24 | 0.2749 | 0.2567 | 0.0967 | 0.024* | |
C25 | 0.1131 (4) | 0.2815 (3) | 0.0481 (2) | 0.0256 (11) | |
H25 | 0.1588 | 0.3180 | 0.0175 | 0.031* | |
C26 | −0.0226 (4) | 0.2651 (3) | 0.0458 (2) | 0.0264 (11) | |
H26 | −0.0700 | 0.2904 | 0.0136 | 0.032* | |
C27 | −0.0893 (4) | 0.2119 (3) | 0.0902 (2) | 0.0229 (10) | |
H27 | −0.1823 | 0.2017 | 0.0892 | 0.028* | |
C28 | −0.0209 (4) | 0.1735 (3) | 0.1364 (2) | 0.0192 (9) | |
H28 | −0.0670 | 0.1360 | 0.1660 | 0.023* | |
C29 | 0.2263 (4) | 0.0595 (3) | 0.1382 (2) | 0.0158 (9) | |
C30 | 0.1691 (4) | 0.0471 (3) | 0.0691 (2) | 0.0195 (10) | |
H30 | 0.1166 | 0.0800 | 0.0512 | 0.023* | |
C31 | 0.1881 (4) | −0.0129 (3) | 0.0260 (2) | 0.0251 (11) | |
H31 | 0.1506 | −0.0197 | −0.0214 | 0.030* | |
C32 | 0.2605 (4) | −0.0625 (3) | 0.0513 (2) | 0.0246 (10) | |
H32 | 0.2705 | −0.1045 | 0.0220 | 0.030* | |
C33 | 0.3193 (4) | −0.0510 (3) | 0.1201 (2) | 0.0249 (11) | |
H33 | 0.3708 | −0.0846 | 0.1376 | 0.030* | |
C34 | 0.3023 (4) | 0.0096 (3) | 0.1626 (2) | 0.0223 (10) | |
H34 | 0.3431 | 0.0174 | 0.2094 | 0.027* | |
C35 | 0.1064 (4) | 0.0964 (3) | 0.2607 (2) | 0.0182 (9) | |
H35 | 0.0774 | 0.0413 | 0.2641 | 0.022* | |
C36 | 0.0654 (4) | 0.1549 (3) | 0.3099 (2) | 0.0204 (10) | |
H36A | 0.0431 | 0.1963 | 0.2810 | 0.025* | |
H36B | −0.0159 | 0.1269 | 0.3298 | 0.025* | |
C37 | 0.1649 (4) | 0.1948 (3) | 0.3706 (2) | 0.0193 (10) | |
H37A | 0.2029 | 0.1546 | 0.3931 | 0.023* | |
H37B | 0.1172 | 0.2154 | 0.4060 | 0.023* | |
C38 | 0.2178 (4) | 0.3504 (3) | 0.3206 (2) | 0.0174 (9) | |
C39 | 0.2053 (4) | 0.3658 (3) | 0.2501 (2) | 0.0208 (10) | |
H39 | 0.2414 | 0.3380 | 0.2171 | 0.025* | |
C40 | 0.1405 (4) | 0.4214 (3) | 0.2269 (2) | 0.0220 (10) | |
H40 | 0.1303 | 0.4303 | 0.1782 | 0.026* | |
C41 | 0.0911 (4) | 0.4635 (3) | 0.2747 (2) | 0.0260 (11) | |
H41 | 0.0482 | 0.5022 | 0.2593 | 0.031* | |
C42 | 0.1047 (5) | 0.4489 (3) | 0.3456 (2) | 0.0372 (14) | |
H42 | 0.0715 | 0.4781 | 0.3788 | 0.045* | |
C43 | 0.1659 (5) | 0.3927 (3) | 0.3679 (2) | 0.0324 (13) | |
H43 | 0.1728 | 0.3825 | 0.4164 | 0.039* | |
C44 | 0.3843 (4) | 0.3140 (3) | 0.4337 (2) | 0.0210 (10) | |
C45 | 0.4909 (5) | 0.3775 (3) | 0.4357 (2) | 0.0566 (18) | |
H45A | 0.4607 | 0.4195 | 0.4114 | 0.068* | |
H45B | 0.5550 | 0.3625 | 0.4069 | 0.068* | |
C46 | 0.5602 (5) | 0.4111 (3) | 0.4991 (3) | 0.085 (3) | |
H46 | 0.6336 | 0.4552 | 0.4994 | 0.102* | |
C47 | 0.5213 (5) | 0.3798 (3) | 0.5610 (2) | 0.0516 (16) | |
H47 | 0.5683 | 0.4022 | 0.6044 | 0.062* | |
C48 | 0.4156 (4) | 0.3168 (3) | 0.5608 (2) | 0.0359 (13) | |
H48 | 0.3890 | 0.2955 | 0.6038 | 0.043* | |
C49 | 0.3468 (4) | 0.2837 (3) | 0.4974 (2) | 0.0298 (11) | |
H49 | 0.2733 | 0.2398 | 0.4976 | 0.036* | |
C50 | 0.6527 (4) | 0.0962 (3) | 0.2826 (2) | 0.0179 (9) | |
C51 | 0.6416 (4) | 0.0806 (3) | 0.2098 (2) | 0.0214 (10) | |
H51 | 0.5998 | 0.1103 | 0.1792 | 0.026* | |
C52 | 0.6915 (4) | 0.0218 (3) | 0.1824 (3) | 0.0275 (11) | |
H52 | 0.6850 | 0.0119 | 0.1331 | 0.033* | |
C53 | 0.7504 (4) | −0.0222 (3) | 0.2263 (3) | 0.0293 (12) | |
H53 | 0.7842 | −0.0624 | 0.2071 | 0.035* | |
C54 | 0.7605 (4) | −0.0080 (3) | 0.2983 (3) | 0.0295 (12) | |
H54 | 0.8009 | −0.0388 | 0.3285 | 0.035* | |
C55 | 0.7116 (4) | 0.0513 (3) | 0.3266 (2) | 0.0220 (10) | |
H55 | 0.7188 | 0.0609 | 0.3761 | 0.026* | |
C56 | 0.5544 (4) | 0.1494 (3) | 0.4043 (2) | 0.0180 (9) | |
C57 | 0.4425 (4) | 0.0884 (3) | 0.4092 (2) | 0.0232 (10) | |
H57 | 0.3946 | 0.0617 | 0.3676 | 0.028* | |
C58 | 0.4006 (4) | 0.0663 (3) | 0.4738 (2) | 0.0278 (11) | |
H58 | 0.3255 | 0.0239 | 0.4763 | 0.033* | |
C59 | 0.4674 (5) | 0.1057 (3) | 0.5348 (2) | 0.0315 (12) | |
H59 | 0.4372 | 0.0911 | 0.5791 | 0.038* | |
C60 | 0.5778 (5) | 0.1660 (3) | 0.5311 (2) | 0.0327 (12) | |
H60 | 0.6246 | 0.1928 | 0.5730 | 0.039* | |
C61 | 0.6211 (4) | 0.1882 (3) | 0.4658 (2) | 0.0245 (10) | |
H61 | 0.6970 | 0.2301 | 0.4637 | 0.029* | |
C62 | 0.7435 (4) | 0.2573 (3) | 0.3283 (2) | 0.0179 (9) | |
H62A | 0.7277 | 0.3002 | 0.3579 | 0.022* | |
H62B | 0.8141 | 0.2381 | 0.3536 | 0.022* | |
C63 | 0.7910 (4) | 0.2905 (3) | 0.2587 (2) | 0.0165 (9) | |
H63A | 0.8878 | 0.3107 | 0.2652 | 0.020* | |
H63B | 0.7703 | 0.2470 | 0.2224 | 0.020* | |
C64 | 0.7316 (4) | 0.3561 (3) | 0.2311 (2) | 0.0183 (9) | |
H64A | 0.7893 | 0.3852 | 0.1974 | 0.022* | |
H64B | 0.7321 | 0.3931 | 0.2710 | 0.022* | |
C65 | 0.5173 (4) | 0.4162 (3) | 0.1735 (2) | 0.0160 (9) | |
C66 | 0.4562 (4) | 0.4311 (3) | 0.1095 (2) | 0.0223 (10) | |
H66 | 0.4427 | 0.3941 | 0.0709 | 0.027* | |
C67 | 0.4145 (4) | 0.5001 (3) | 0.1019 (2) | 0.0245 (11) | |
H67 | 0.3748 | 0.5105 | 0.0580 | 0.029* | |
C68 | 0.4318 (5) | 0.5522 (3) | 0.1582 (3) | 0.0305 (12) | |
H68 | 0.4023 | 0.5985 | 0.1533 | 0.037* | |
C69 | 0.4916 (5) | 0.5385 (3) | 0.2223 (2) | 0.0310 (12) | |
H69 | 0.5044 | 0.5755 | 0.2609 | 0.037* | |
C70 | 0.5325 (4) | 0.4702 (3) | 0.2293 (2) | 0.0227 (10) | |
H70 | 0.5720 | 0.4603 | 0.2734 | 0.027* | |
C71 | 0.5872 (4) | 0.2907 (3) | 0.0999 (2) | 0.0154 (9) | |
C72 | 0.6675 (4) | 0.3406 (3) | 0.0568 (2) | 0.0187 (9) | |
H72 | 0.7113 | 0.3925 | 0.0735 | 0.022* | |
C73 | 0.6833 (4) | 0.3150 (3) | −0.0097 (2) | 0.0214 (10) | |
H73 | 0.7363 | 0.3496 | −0.0390 | 0.026* | |
C74 | 0.6222 (4) | 0.2389 (3) | −0.0339 (2) | 0.0245 (11) | |
H74 | 0.6349 | 0.2212 | −0.0794 | 0.029* | |
C75 | 0.5432 (4) | 0.1889 (3) | 0.0076 (2) | 0.0225 (10) | |
H75 | 0.5011 | 0.1367 | −0.0092 | 0.027* | |
C76 | 0.5250 (4) | 0.2150 (3) | 0.0746 (2) | 0.0180 (9) | |
H76 | 0.4696 | 0.1807 | 0.1031 | 0.022* |
U11 | U22 | U33 | U12 | U13 | U23 | |
Sn1 | 0.01322 (14) | 0.01595 (17) | 0.01312 (15) | 0.00299 (12) | 0.00177 (11) | 0.00034 (12) |
Ag1 | 0.01216 (15) | 0.01514 (18) | 0.01399 (16) | 0.00362 (13) | 0.00165 (12) | 0.00158 (13) |
Cl1 | 0.0229 (6) | 0.0264 (7) | 0.0336 (7) | 0.0011 (5) | −0.0020 (5) | 0.0000 (5) |
Cl2 | 0.0327 (6) | 0.0326 (7) | 0.0199 (6) | 0.0051 (5) | −0.0038 (5) | −0.0009 (5) |
P1 | 0.0130 (5) | 0.0145 (6) | 0.0143 (5) | 0.0029 (4) | 0.0007 (4) | 0.0020 (5) |
P2 | 0.0162 (5) | 0.0194 (6) | 0.0145 (5) | 0.0057 (5) | 0.0034 (4) | 0.0006 (5) |
P3 | 0.0160 (5) | 0.0140 (6) | 0.0155 (6) | 0.0025 (5) | 0.0017 (4) | 0.0011 (5) |
P4 | 0.0131 (5) | 0.0161 (6) | 0.0164 (6) | 0.0036 (5) | 0.0001 (4) | 0.0023 (5) |
F1 | 0.0449 (16) | 0.0296 (17) | 0.0143 (13) | 0.0131 (14) | 0.0064 (12) | −0.0045 (12) |
F2 | 0.0426 (16) | 0.0179 (16) | 0.0309 (15) | 0.0121 (13) | −0.0032 (12) | 0.0003 (12) |
F3 | 0.0325 (16) | 0.055 (2) | 0.0360 (17) | 0.0216 (15) | 0.0027 (13) | −0.0212 (15) |
F4 | 0.0470 (17) | 0.0209 (17) | 0.0308 (16) | 0.0071 (14) | −0.0009 (13) | −0.0018 (13) |
O1 | 0.0225 (15) | 0.0171 (17) | 0.0119 (14) | 0.0036 (13) | 0.0036 (12) | −0.0004 (13) |
O2 | 0.0261 (17) | 0.026 (2) | 0.0215 (17) | −0.0005 (15) | 0.0089 (13) | 0.0020 (15) |
O3 | 0.0196 (15) | 0.0210 (18) | 0.0205 (16) | 0.0057 (13) | 0.0043 (12) | −0.0019 (14) |
O4 | 0.0175 (16) | 0.034 (2) | 0.0298 (18) | 0.0040 (15) | 0.0013 (13) | −0.0066 (16) |
C1 | 0.019 (2) | 0.020 (3) | 0.013 (2) | 0.0068 (19) | 0.0038 (16) | 0.0006 (19) |
C2 | 0.025 (2) | 0.029 (3) | 0.017 (2) | 0.003 (2) | 0.0011 (18) | 0.002 (2) |
C3 | 0.025 (2) | 0.026 (3) | 0.031 (3) | −0.005 (2) | 0.005 (2) | 0.005 (2) |
C4 | 0.037 (3) | 0.027 (3) | 0.020 (2) | 0.013 (2) | 0.012 (2) | 0.010 (2) |
C5 | 0.036 (3) | 0.028 (3) | 0.019 (2) | 0.008 (2) | −0.002 (2) | 0.006 (2) |
C6 | 0.028 (2) | 0.022 (3) | 0.019 (2) | 0.003 (2) | −0.0019 (19) | −0.003 (2) |
C7 | 0.0094 (18) | 0.018 (2) | 0.014 (2) | −0.0011 (17) | −0.0001 (15) | 0.0000 (18) |
C8 | 0.018 (2) | 0.018 (3) | 0.031 (3) | 0.0037 (19) | 0.0032 (19) | −0.004 (2) |
C9 | 0.016 (2) | 0.019 (3) | 0.038 (3) | 0.007 (2) | 0.0031 (19) | −0.003 (2) |
C10 | 0.014 (2) | 0.028 (3) | 0.024 (2) | 0.005 (2) | 0.0010 (18) | 0.000 (2) |
C11 | 0.017 (2) | 0.017 (3) | 0.027 (2) | −0.0002 (19) | −0.0009 (18) | 0.003 (2) |
C12 | 0.017 (2) | 0.017 (2) | 0.023 (2) | 0.0062 (19) | 0.0043 (17) | 0.004 (2) |
C13 | 0.019 (2) | 0.014 (2) | 0.012 (2) | 0.0052 (18) | −0.0009 (16) | −0.0007 (18) |
C14 | 0.020 (2) | 0.021 (3) | 0.032 (3) | 0.004 (2) | 0.0048 (19) | 0.009 (2) |
C15 | 0.014 (2) | 0.028 (3) | 0.035 (3) | 0.004 (2) | −0.0036 (19) | 0.003 (2) |
C16 | 0.026 (2) | 0.040 (3) | 0.022 (2) | 0.014 (2) | −0.0053 (19) | 0.004 (2) |
C17 | 0.027 (3) | 0.044 (4) | 0.032 (3) | 0.006 (2) | 0.003 (2) | 0.021 (3) |
C18 | 0.020 (2) | 0.030 (3) | 0.030 (3) | 0.000 (2) | 0.0010 (19) | 0.013 (2) |
C19 | 0.020 (2) | 0.018 (3) | 0.015 (2) | 0.0077 (19) | 0.0034 (17) | 0.0015 (19) |
C20 | 0.027 (2) | 0.014 (2) | 0.023 (2) | 0.006 (2) | 0.0040 (19) | 0.003 (2) |
C21 | 0.025 (2) | 0.020 (3) | 0.014 (2) | 0.010 (2) | 0.0025 (17) | 0.0058 (19) |
C22 | 0.020 (2) | 0.022 (3) | 0.027 (3) | 0.008 (2) | −0.0014 (19) | −0.002 (2) |
C23 | 0.019 (2) | 0.013 (2) | 0.014 (2) | 0.0039 (18) | −0.0011 (16) | −0.0006 (18) |
C24 | 0.017 (2) | 0.022 (3) | 0.021 (2) | 0.0057 (19) | 0.0027 (17) | 0.002 (2) |
C25 | 0.028 (2) | 0.026 (3) | 0.027 (3) | 0.011 (2) | 0.005 (2) | 0.015 (2) |
C26 | 0.024 (2) | 0.038 (3) | 0.022 (2) | 0.016 (2) | 0.0017 (19) | 0.004 (2) |
C27 | 0.018 (2) | 0.036 (3) | 0.016 (2) | 0.012 (2) | −0.0037 (17) | −0.002 (2) |
C28 | 0.018 (2) | 0.020 (3) | 0.018 (2) | 0.0033 (19) | 0.0011 (17) | 0.000 (2) |
C29 | 0.017 (2) | 0.016 (2) | 0.013 (2) | 0.0013 (18) | 0.0039 (16) | 0.0049 (18) |
C30 | 0.018 (2) | 0.020 (3) | 0.022 (2) | 0.0084 (19) | −0.0018 (17) | 0.001 (2) |
C31 | 0.027 (2) | 0.031 (3) | 0.018 (2) | 0.010 (2) | −0.0003 (19) | 0.001 (2) |
C32 | 0.027 (2) | 0.020 (3) | 0.027 (3) | 0.006 (2) | 0.006 (2) | −0.007 (2) |
C33 | 0.025 (2) | 0.021 (3) | 0.031 (3) | 0.010 (2) | 0.004 (2) | 0.003 (2) |
C34 | 0.021 (2) | 0.027 (3) | 0.019 (2) | 0.010 (2) | −0.0058 (18) | 0.000 (2) |
C35 | 0.022 (2) | 0.014 (2) | 0.018 (2) | −0.0008 (18) | 0.0095 (17) | 0.0034 (19) |
C36 | 0.017 (2) | 0.026 (3) | 0.018 (2) | 0.0040 (19) | 0.0037 (17) | 0.002 (2) |
C37 | 0.023 (2) | 0.024 (3) | 0.012 (2) | 0.009 (2) | 0.0033 (17) | 0.0010 (19) |
C38 | 0.020 (2) | 0.018 (2) | 0.016 (2) | 0.0072 (19) | 0.0037 (17) | 0.0048 (19) |
C39 | 0.023 (2) | 0.024 (3) | 0.017 (2) | 0.008 (2) | 0.0058 (18) | 0.000 (2) |
C40 | 0.028 (2) | 0.024 (3) | 0.013 (2) | 0.006 (2) | −0.0013 (18) | 0.001 (2) |
C41 | 0.028 (2) | 0.018 (3) | 0.036 (3) | 0.011 (2) | 0.004 (2) | 0.008 (2) |
C42 | 0.061 (4) | 0.038 (4) | 0.024 (3) | 0.033 (3) | 0.004 (2) | −0.003 (2) |
C43 | 0.052 (3) | 0.037 (3) | 0.018 (2) | 0.026 (3) | 0.010 (2) | 0.007 (2) |
C44 | 0.021 (2) | 0.029 (3) | 0.014 (2) | 0.008 (2) | 0.0034 (17) | −0.0028 (19) |
C45 | 0.056 (4) | 0.068 (5) | 0.026 (3) | −0.022 (3) | 0.007 (3) | −0.002 (3) |
C46 | 0.073 (4) | 0.108 (6) | 0.034 (3) | −0.047 (4) | 0.003 (3) | −0.011 (4) |
C47 | 0.045 (3) | 0.072 (5) | 0.023 (3) | −0.007 (3) | −0.003 (2) | −0.010 (3) |
C48 | 0.045 (3) | 0.040 (3) | 0.021 (3) | 0.008 (3) | 0.001 (2) | 0.008 (2) |
C49 | 0.037 (3) | 0.032 (3) | 0.019 (2) | 0.008 (2) | −0.001 (2) | 0.003 (2) |
C50 | 0.0111 (19) | 0.015 (2) | 0.027 (2) | 0.0020 (17) | 0.0006 (17) | 0.0003 (19) |
C51 | 0.019 (2) | 0.023 (3) | 0.024 (2) | 0.004 (2) | 0.0077 (18) | 0.006 (2) |
C52 | 0.029 (3) | 0.019 (3) | 0.032 (3) | −0.001 (2) | 0.014 (2) | −0.005 (2) |
C53 | 0.019 (2) | 0.015 (3) | 0.053 (3) | 0.000 (2) | 0.011 (2) | −0.007 (2) |
C54 | 0.012 (2) | 0.016 (3) | 0.059 (4) | 0.0017 (19) | −0.004 (2) | 0.005 (2) |
C55 | 0.013 (2) | 0.025 (3) | 0.025 (2) | 0.0022 (19) | −0.0049 (17) | 0.001 (2) |
C56 | 0.014 (2) | 0.021 (3) | 0.022 (2) | 0.0112 (19) | 0.0004 (17) | 0.007 (2) |
C57 | 0.021 (2) | 0.024 (3) | 0.024 (2) | 0.006 (2) | −0.0025 (18) | 0.004 (2) |
C58 | 0.026 (2) | 0.029 (3) | 0.031 (3) | 0.007 (2) | 0.011 (2) | 0.018 (2) |
C59 | 0.040 (3) | 0.040 (3) | 0.018 (2) | 0.013 (3) | 0.010 (2) | 0.011 (2) |
C60 | 0.040 (3) | 0.039 (3) | 0.020 (3) | 0.010 (3) | 0.004 (2) | 0.007 (2) |
C61 | 0.025 (2) | 0.026 (3) | 0.020 (2) | 0.003 (2) | 0.0018 (19) | 0.008 (2) |
C62 | 0.019 (2) | 0.016 (2) | 0.018 (2) | 0.0033 (18) | −0.0002 (17) | 0.0016 (19) |
C63 | 0.0113 (19) | 0.017 (2) | 0.020 (2) | 0.0021 (17) | 0.0008 (16) | −0.0005 (19) |
C64 | 0.020 (2) | 0.018 (2) | 0.014 (2) | 0.0021 (19) | 0.0011 (17) | −0.0015 (19) |
C65 | 0.016 (2) | 0.016 (2) | 0.015 (2) | 0.0003 (18) | 0.0032 (16) | 0.0011 (18) |
C66 | 0.022 (2) | 0.022 (3) | 0.020 (2) | 0.002 (2) | 0.0018 (18) | −0.008 (2) |
C67 | 0.030 (2) | 0.020 (3) | 0.026 (3) | 0.012 (2) | 0.000 (2) | −0.001 (2) |
C68 | 0.038 (3) | 0.021 (3) | 0.036 (3) | 0.012 (2) | 0.005 (2) | 0.006 (2) |
C69 | 0.046 (3) | 0.026 (3) | 0.022 (3) | 0.012 (3) | 0.002 (2) | −0.004 (2) |
C70 | 0.031 (2) | 0.016 (3) | 0.021 (2) | 0.006 (2) | 0.0006 (19) | 0.000 (2) |
C71 | 0.0111 (19) | 0.019 (2) | 0.016 (2) | 0.0042 (18) | −0.0014 (16) | 0.0001 (19) |
C72 | 0.018 (2) | 0.017 (2) | 0.021 (2) | 0.0038 (19) | 0.0001 (17) | 0.005 (2) |
C73 | 0.021 (2) | 0.028 (3) | 0.021 (2) | 0.012 (2) | 0.0069 (18) | 0.008 (2) |
C74 | 0.025 (2) | 0.039 (3) | 0.017 (2) | 0.022 (2) | 0.0037 (18) | 0.001 (2) |
C75 | 0.022 (2) | 0.023 (3) | 0.024 (2) | 0.013 (2) | −0.0079 (18) | −0.010 (2) |
C76 | 0.0110 (19) | 0.021 (3) | 0.022 (2) | 0.0046 (18) | 0.0010 (17) | 0.002 (2) |
Sn1—C1 | 2.128 (4) | C33—C34 | 1.384 (6) |
Sn1—C7 | 2.128 (4) | C33—H33 | 0.9500 |
Sn1—C13 | 2.115 (4) | C34—H34 | 0.9500 |
Sn1—O1 | 2.233 (3) | C35—C36 | 1.543 (6) |
Sn1—O3 | 2.208 (3) | C35—H35 | 0.9500 |
Ag1—P1 | 2.460 (1) | C36—C37 | 1.524 (6) |
Ag1—P2 | 2.501 (1) | C36—H36A | 0.9900 |
Ag1—P3 | 2.463 (1) | C36—H36B | 0.9900 |
Ag1—P4 | 2.470 (1) | C37—H37A | 0.9900 |
Cl1—C20 | 1.769 (4) | C37—H37B | 0.9900 |
Cl2—C22 | 1.773 (4) | C38—C39 | 1.385 (5) |
P1—C29 | 1.821 (4) | C38—C43 | 1.390 (6) |
P1—C23 | 1.822 (4) | C39—C40 | 1.392 (6) |
P1—C35 | 1.833 (4) | C39—H39 | 0.9500 |
P2—C44 | 1.818 (4) | C40—C41 | 1.379 (6) |
P2—C38 | 1.831 (4) | C40—H40 | 0.9500 |
P2—C37 | 1.834 (5) | C41—C42 | 1.390 (6) |
P3—C65 | 1.825 (4) | C41—H41 | 0.9500 |
P3—C71 | 1.827 (4) | C42—C43 | 1.373 (6) |
P3—C64 | 1.845 (4) | C42—H42 | 0.9500 |
P4—C56 | 1.810 (4) | C43—H43 | 0.9500 |
P4—C50 | 1.831 (4) | C44—C45 | 1.373 (6) |
P4—C62 | 1.835 (4) | C44—C49 | 1.394 (6) |
F1—C20 | 1.334 (5) | C45—C46 | 1.396 (6) |
F2—C20 | 1.358 (5) | C45—H45A | 0.9900 |
F3—C22 | 1.342 (4) | C45—H45B | 0.9900 |
F4—C22 | 1.348 (5) | C46—C47 | 1.373 (6) |
O1—C19 | 1.282 (4) | C46—H46 | 0.9500 |
O2—C19 | 1.204 (5) | C47—C48 | 1.363 (6) |
O3—C21 | 1.268 (4) | C47—H47 | 0.9500 |
O4—C21 | 1.209 (5) | C48—C49 | 1.391 (5) |
C1—C2 | 1.382 (6) | C48—H48 | 0.9500 |
C1—C6 | 1.390 (6) | C49—H49 | 0.9500 |
C2—C3 | 1.395 (6) | C50—C55 | 1.386 (5) |
C2—H2 | 0.9500 | C50—C51 | 1.403 (6) |
C3—C4 | 1.386 (6) | C51—C52 | 1.386 (6) |
C3—H3 | 0.9500 | C51—H51 | 0.9500 |
C4—C5 | 1.381 (7) | C52—C53 | 1.371 (6) |
C4—H4 | 0.9500 | C52—H52 | 0.9500 |
C5—C6 | 1.371 (6) | C53—C54 | 1.385 (7) |
C5—H5 | 0.9500 | C53—H53 | 0.9500 |
C6—H6 | 0.9500 | C54—C55 | 1.396 (6) |
C7—C12 | 1.380 (6) | C54—H54 | 0.9500 |
C7—C8 | 1.382 (5) | C55—H55 | 0.9500 |
C8—C9 | 1.391 (6) | C56—C61 | 1.386 (6) |
C8—H8 | 0.9500 | C56—C57 | 1.396 (6) |
C9—C10 | 1.378 (6) | C57—C58 | 1.381 (6) |
C9—H9 | 0.9500 | C57—H57 | 0.9500 |
C10—C11 | 1.384 (6) | C58—C59 | 1.382 (7) |
C10—H10 | 0.9500 | C58—H58 | 0.9500 |
C11—C12 | 1.390 (5) | C59—C60 | 1.376 (7) |
C11—H11 | 0.9500 | C59—H59 | 0.9500 |
C12—H12 | 0.9500 | C60—C61 | 1.399 (6) |
C13—C14 | 1.384 (6) | C60—H60 | 0.9500 |
C13—C18 | 1.398 (6) | C61—H61 | 0.9500 |
C14—C15 | 1.382 (6) | C62—C63 | 1.542 (5) |
C14—H14 | 0.9500 | C62—H62A | 0.9900 |
C15—C16 | 1.375 (7) | C62—H62B | 0.9900 |
C15—H15 | 0.9500 | C63—C64 | 1.535 (5) |
C16—C17 | 1.376 (6) | C63—H63A | 0.9900 |
C16—H16 | 0.9500 | C63—H63B | 0.9900 |
C17—C18 | 1.393 (6) | C64—H64A | 0.9900 |
C17—H17 | 0.9500 | C64—H64B | 0.9900 |
C18—H18 | 0.9500 | C65—C70 | 1.383 (6) |
C19—C20 | 1.543 (6) | C65—C66 | 1.396 (6) |
C21—C22 | 1.544 (6) | C66—C67 | 1.402 (6) |
C23—C24 | 1.392 (6) | C66—H66 | 0.9500 |
C23—C28 | 1.394 (5) | C67—C68 | 1.368 (6) |
C24—C25 | 1.378 (5) | C67—H67 | 0.9500 |
C24—H24 | 0.9500 | C68—C69 | 1.386 (6) |
C25—C26 | 1.385 (6) | C68—H68 | 0.9500 |
C25—H25 | 0.9500 | C69—C70 | 1.385 (6) |
C26—C27 | 1.385 (6) | C69—H69 | 0.9500 |
C26—H26 | 0.9500 | C70—H70 | 0.9500 |
C27—C28 | 1.390 (5) | C71—C76 | 1.385 (6) |
C27—H27 | 0.9500 | C71—C72 | 1.400 (6) |
C28—H28 | 0.9500 | C72—C73 | 1.375 (6) |
C29—C30 | 1.394 (6) | C72—H72 | 0.9500 |
C29—C34 | 1.396 (5) | C73—C74 | 1.384 (7) |
C30—C31 | 1.389 (6) | C73—H73 | 0.9500 |
C30—H30 | 0.9500 | C74—C75 | 1.375 (7) |
C31—C32 | 1.371 (6) | C74—H74 | 0.9500 |
C31—H31 | 0.9500 | C75—C76 | 1.396 (5) |
C32—C33 | 1.393 (6) | C75—H75 | 0.9500 |
C32—H32 | 0.9500 | C76—H76 | 0.9500 |
C1—Sn1—C7 | 115.2 (2) | C33—C34—C29 | 121.3 (4) |
C1—Sn1—C13 | 127.2 (2) | C33—C34—H34 | 119.4 |
C1—Sn1—O1 | 84.9 (1) | C29—C34—H34 | 119.4 |
C1—Sn1—O3 | 90.8 (1) | C36—C35—P1 | 114.9 (3) |
C7—Sn1—C13 | 117.6 (2) | C36—C35—H35 | 122.5 |
C7—Sn1—O1 | 95.8 (1) | P1—C35—H35 | 122.5 |
C7—Sn1—O3 | 86.9 (1) | C37—C36—C35 | 117.3 (3) |
C13—Sn1—O3 | 93.2 (1) | C37—C36—H36A | 108.0 |
C13—Sn1—O1 | 88.7 (1) | C35—C36—H36A | 108.0 |
O1—Sn1—O3 | 175.6 (1) | C37—C36—H36B | 108.0 |
P1—Ag1—P2 | 93.58 (4) | C35—C36—H36B | 108.0 |
P1—Ag1—P3 | 119.54 (4) | H36A—C36—H36B | 107.2 |
P1—Ag1—P4 | 122.91 (4) | C36—C37—P2 | 116.3 (3) |
P2—Ag1—P3 | 118.95 (4) | C36—C37—H37A | 108.2 |
P2—Ag1—P4 | 106.23 (4) | P2—C37—H37A | 108.2 |
P3—Ag1—P4 | 96.64 (4) | C36—C37—H37B | 108.2 |
C29—P1—C23 | 102.35 (18) | P2—C37—H37B | 108.2 |
C29—P1—C35 | 104.7 (2) | H37A—C37—H37B | 107.4 |
C23—P1—C35 | 104.52 (18) | C39—C38—C43 | 118.5 (4) |
C29—P1—Ag1 | 119.20 (13) | C39—C38—P2 | 119.3 (3) |
C23—P1—Ag1 | 115.03 (15) | C43—C38—P2 | 122.2 (3) |
C35—P1—Ag1 | 109.63 (14) | C38—C39—C40 | 120.9 (4) |
C44—P2—C38 | 103.21 (19) | C38—C39—H39 | 119.6 |
C44—P2—C37 | 103.13 (19) | C40—C39—H39 | 119.6 |
C38—P2—C37 | 103.20 (19) | C41—C40—C39 | 119.9 (4) |
C44—P2—Ag1 | 121.75 (12) | C41—C40—H40 | 120.1 |
C38—P2—Ag1 | 114.10 (13) | C39—C40—H40 | 120.1 |
C37—P2—Ag1 | 109.46 (14) | C40—C41—C42 | 119.5 (4) |
C65—P3—C71 | 103.91 (18) | C40—C41—H41 | 120.3 |
C65—P3—C64 | 103.5 (2) | C42—C41—H41 | 120.3 |
C71—P3—C64 | 103.10 (18) | C43—C42—C41 | 120.4 (4) |
C65—P3—Ag1 | 116.75 (13) | C43—C42—H42 | 119.8 |
C71—P3—Ag1 | 115.99 (15) | C41—C42—H42 | 119.8 |
C64—P3—Ag1 | 112.00 (14) | C42—C43—C38 | 120.9 (4) |
C56—P4—C50 | 103.42 (19) | C42—C43—H43 | 119.6 |
C56—P4—C62 | 106.1 (2) | C38—C43—H43 | 119.6 |
C50—P4—C62 | 102.09 (19) | C45—C44—C49 | 117.7 (4) |
C56—P4—Ag1 | 111.49 (12) | C45—C44—P2 | 118.1 (3) |
C50—P4—Ag1 | 124.14 (14) | C49—C44—P2 | 124.3 (3) |
C62—P4—Ag1 | 108.08 (13) | C44—C45—C46 | 121.6 (4) |
C19—O1—Sn1 | 119.0 (3) | C44—C45—H45A | 106.9 |
C21—O3—Sn1 | 119.3 (3) | C46—C45—H45A | 106.9 |
C2—C1—C6 | 118.3 (4) | C44—C45—H45B | 106.9 |
C2—C1—Sn1 | 122.7 (3) | C46—C45—H45B | 106.9 |
C6—C1—Sn1 | 118.9 (3) | H45A—C45—H45B | 106.7 |
C1—C2—C3 | 120.9 (4) | C47—C46—C45 | 119.3 (5) |
C1—C2—H2 | 119.6 | C47—C46—H46 | 120.3 |
C3—C2—H2 | 119.6 | C45—C46—H46 | 120.3 |
C4—C3—C2 | 119.8 (5) | C48—C47—C46 | 120.4 (5) |
C4—C3—H3 | 120.1 | C48—C47—H47 | 119.8 |
C2—C3—H3 | 120.1 | C46—C47—H47 | 119.8 |
C5—C4—C3 | 119.3 (4) | C47—C48—C49 | 119.9 (4) |
C5—C4—H4 | 120.4 | C47—C48—H48 | 120.0 |
C3—C4—H4 | 120.4 | C49—C48—H48 | 120.0 |
C6—C5—C4 | 120.6 (4) | C48—C49—C44 | 121.0 (4) |
C6—C5—H5 | 119.7 | C48—C49—H49 | 119.5 |
C4—C5—H5 | 119.7 | C44—C49—H49 | 119.5 |
C5—C6—C1 | 121.1 (5) | C55—C50—C51 | 119.2 (4) |
C5—C6—H6 | 119.5 | C55—C50—P4 | 121.8 (3) |
C1—C6—H6 | 119.5 | C51—C50—P4 | 119.0 (3) |
C12—C7—C8 | 118.5 (4) | C52—C51—C50 | 120.1 (4) |
C12—C7—Sn1 | 120.7 (3) | C52—C51—H51 | 120.0 |
C8—C7—Sn1 | 120.8 (3) | C50—C51—H51 | 120.0 |
C7—C8—C9 | 120.3 (4) | C53—C52—C51 | 120.4 (4) |
C7—C8—H8 | 119.8 | C53—C52—H52 | 119.8 |
C9—C8—H8 | 119.8 | C51—C52—H52 | 119.8 |
C10—C9—C8 | 120.7 (4) | C52—C53—C54 | 120.1 (4) |
C10—C9—H9 | 119.7 | C52—C53—H53 | 119.9 |
C8—C9—H9 | 119.7 | C54—C53—H53 | 119.9 |
C9—C10—C11 | 119.4 (4) | C53—C54—C55 | 120.2 (4) |
C9—C10—H10 | 120.3 | C53—C54—H54 | 119.9 |
C11—C10—H10 | 120.3 | C55—C54—H54 | 119.9 |
C10—C11—C12 | 119.3 (4) | C50—C55—C54 | 120.0 (4) |
C10—C11—H11 | 120.3 | C50—C55—H55 | 120.0 |
C12—C11—H11 | 120.3 | C54—C55—H55 | 120.0 |
C7—C12—C11 | 121.6 (4) | C61—C56—C57 | 118.3 (4) |
C7—C12—H12 | 119.2 | C61—C56—P4 | 124.7 (4) |
C11—C12—H12 | 119.2 | C57—C56—P4 | 116.7 (3) |
C14—C13—C18 | 117.4 (4) | C58—C57—C56 | 120.9 (4) |
C14—C13—Sn1 | 123.6 (3) | C58—C57—H57 | 119.6 |
C18—C13—Sn1 | 118.9 (3) | C56—C57—H57 | 119.6 |
C15—C14—C13 | 122.1 (4) | C57—C58—C59 | 120.4 (5) |
C15—C14—H14 | 118.9 | C57—C58—H58 | 119.8 |
C13—C14—H14 | 118.9 | C59—C58—H58 | 119.8 |
C16—C15—C14 | 119.6 (4) | C60—C59—C58 | 119.6 (4) |
C16—C15—H15 | 120.2 | C60—C59—H59 | 120.2 |
C14—C15—H15 | 120.2 | C58—C59—H59 | 120.2 |
C15—C16—C17 | 120.1 (4) | C59—C60—C61 | 120.1 (5) |
C15—C16—H16 | 120.0 | C59—C60—H60 | 119.9 |
C17—C16—H16 | 120.0 | C61—C60—H60 | 119.9 |
C16—C17—C18 | 120.1 (4) | C56—C61—C60 | 120.6 (5) |
C16—C17—H17 | 120.0 | C56—C61—H61 | 119.7 |
C18—C17—H17 | 120.0 | C60—C61—H61 | 119.7 |
C17—C18—C13 | 120.7 (4) | C63—C62—P4 | 113.8 (3) |
C17—C18—H18 | 119.6 | C63—C62—H62A | 108.8 |
C13—C18—H18 | 119.6 | P4—C62—H62A | 108.8 |
O2—C19—O1 | 129.8 (4) | C63—C62—H62B | 108.8 |
O2—C19—C20 | 118.3 (4) | P4—C62—H62B | 108.8 |
O1—C19—C20 | 111.9 (4) | H62A—C62—H62B | 107.7 |
F1—C20—F2 | 106.7 (3) | C64—C63—C62 | 115.4 (3) |
F1—C20—C19 | 111.8 (4) | C64—C63—H63A | 108.4 |
F2—C20—C19 | 111.0 (3) | C62—C63—H63A | 108.4 |
F1—C20—Cl1 | 108.0 (3) | C64—C63—H63B | 108.4 |
F2—C20—Cl1 | 108.2 (3) | C62—C63—H63B | 108.4 |
C19—C20—Cl1 | 111.0 (3) | H63A—C63—H63B | 107.5 |
O4—C21—O3 | 130.4 (4) | C63—C64—P3 | 115.7 (3) |
O4—C21—C22 | 118.8 (4) | C63—C64—H64A | 108.4 |
O3—C21—C22 | 110.9 (4) | P3—C64—H64A | 108.4 |
F3—C22—F4 | 107.1 (4) | C63—C64—H64B | 108.4 |
F3—C22—C21 | 111.6 (4) | P3—C64—H64B | 108.4 |
F4—C22—C21 | 111.4 (3) | H64A—C64—H64B | 107.4 |
F3—C22—Cl2 | 107.4 (3) | C70—C65—C66 | 118.3 (4) |
F4—C22—Cl2 | 108.2 (3) | C70—C65—P3 | 119.4 (3) |
C21—C22—Cl2 | 110.9 (3) | C66—C65—P3 | 122.1 (3) |
C24—C23—C28 | 119.4 (4) | C65—C66—C67 | 120.6 (4) |
C24—C23—P1 | 117.1 (3) | C65—C66—H66 | 119.7 |
C28—C23—P1 | 123.4 (3) | C67—C66—H66 | 119.7 |
C25—C24—C23 | 120.7 (4) | C68—C67—C66 | 119.3 (4) |
C25—C24—H24 | 119.6 | C68—C67—H67 | 120.3 |
C23—C24—H24 | 119.6 | C66—C67—H67 | 120.3 |
C24—C25—C26 | 119.8 (4) | C67—C68—C69 | 121.1 (4) |
C24—C25—H25 | 120.1 | C67—C68—H68 | 119.5 |
C26—C25—H25 | 120.1 | C69—C68—H68 | 119.5 |
C27—C26—C25 | 120.1 (4) | C70—C69—C68 | 119.1 (5) |
C27—C26—H26 | 119.9 | C70—C69—H69 | 120.5 |
C25—C26—H26 | 119.9 | C68—C69—H69 | 120.5 |
C26—C27—C28 | 120.3 (4) | C65—C70—C69 | 121.6 (4) |
C26—C27—H27 | 119.9 | C65—C70—H70 | 119.2 |
C28—C27—H27 | 119.9 | C69—C70—H70 | 119.2 |
C27—C28—C23 | 119.6 (4) | C76—C71—C72 | 118.9 (4) |
C27—C28—H28 | 120.2 | C76—C71—P3 | 120.1 (3) |
C23—C28—H28 | 120.2 | C72—C71—P3 | 121.0 (4) |
C30—C29—C34 | 118.0 (4) | C73—C72—C71 | 120.5 (4) |
C30—C29—P1 | 122.8 (3) | C73—C72—H72 | 119.8 |
C34—C29—P1 | 119.1 (3) | C71—C72—H72 | 119.8 |
C31—C30—C29 | 120.7 (4) | C72—C73—C74 | 120.1 (4) |
C31—C30—H30 | 119.7 | C72—C73—H73 | 119.9 |
C29—C30—H30 | 119.7 | C74—C73—H73 | 119.9 |
C32—C31—C30 | 120.6 (4) | C75—C74—C73 | 120.4 (4) |
C32—C31—H31 | 119.7 | C75—C74—H74 | 119.8 |
C30—C31—H31 | 119.7 | C73—C74—H74 | 119.8 |
C31—C32—C33 | 119.7 (4) | C74—C75—C76 | 119.7 (5) |
C31—C32—H32 | 120.1 | C74—C75—H75 | 120.2 |
C33—C32—H32 | 120.1 | C76—C75—H75 | 120.2 |
C34—C33—C32 | 119.7 (4) | C71—C76—C75 | 120.5 (4) |
C34—C33—H33 | 120.2 | C71—C76—H76 | 119.8 |
C32—C33—H33 | 120.2 | C75—C76—H76 | 119.8 |
P3—Ag1—P1—C29 | 75.36 (15) | C26—C27—C28—C23 | 1.7 (7) |
P4—Ag1—P1—C29 | −46.32 (16) | C24—C23—C28—C27 | −0.8 (6) |
P2—Ag1—P1—C29 | −158.28 (15) | P1—C23—C28—C27 | −177.8 (3) |
P3—Ag1—P1—C23 | −46.74 (14) | C23—P1—C29—C30 | 1.2 (4) |
P4—Ag1—P1—C23 | −168.42 (14) | C35—P1—C29—C30 | 110.0 (4) |
P2—Ag1—P1—C23 | 79.62 (14) | Ag1—P1—C29—C30 | −127.0 (3) |
P3—Ag1—P1—C35 | −164.15 (14) | C23—P1—C29—C34 | 176.8 (3) |
P4—Ag1—P1—C35 | 74.18 (15) | C35—P1—C29—C34 | −74.3 (4) |
P2—Ag1—P1—C35 | −37.79 (15) | Ag1—P1—C29—C34 | 48.6 (4) |
P1—Ag1—P2—C44 | 156.14 (18) | C34—C29—C30—C31 | −0.3 (6) |
P3—Ag1—P2—C44 | −77.05 (18) | P1—C29—C30—C31 | 175.4 (3) |
P4—Ag1—P2—C44 | 30.32 (18) | C29—C30—C31—C32 | 1.8 (7) |
P1—Ag1—P2—C38 | −79.03 (17) | C30—C31—C32—C33 | −2.2 (7) |
P3—Ag1—P2—C38 | 47.78 (17) | C31—C32—C33—C34 | 1.1 (7) |
P4—Ag1—P2—C38 | 155.16 (16) | C32—C33—C34—C29 | 0.4 (7) |
P1—Ag1—P2—C37 | 36.01 (14) | C30—C29—C34—C33 | −0.8 (6) |
P3—Ag1—P2—C37 | 162.82 (14) | P1—C29—C34—C33 | −176.7 (4) |
P4—Ag1—P2—C37 | −89.80 (14) | C29—P1—C35—C36 | −172.0 (3) |
P1—Ag1—P3—C65 | 81.93 (16) | C23—P1—C35—C36 | −64.8 (3) |
P4—Ag1—P3—C65 | −144.06 (16) | Ag1—P1—C35—C36 | 59.0 (3) |
P2—Ag1—P3—C65 | −31.36 (16) | P1—C35—C36—C37 | −78.9 (4) |
P1—Ag1—P3—C71 | −41.11 (14) | C35—C36—C37—P2 | 77.1 (4) |
P4—Ag1—P3—C71 | 92.90 (14) | C44—P2—C37—C36 | 173.6 (3) |
P2—Ag1—P3—C71 | −154.41 (13) | C38—P2—C37—C36 | 66.4 (3) |
P1—Ag1—P3—C64 | −159.07 (15) | Ag1—P2—C37—C36 | −55.4 (3) |
P4—Ag1—P3—C64 | −25.07 (15) | C44—P2—C38—C39 | 145.2 (4) |
P2—Ag1—P3—C64 | 87.63 (15) | C37—P2—C38—C39 | −107.6 (4) |
P1—Ag1—P4—C56 | −81.76 (17) | Ag1—P2—C38—C39 | 11.0 (4) |
P3—Ag1—P4—C56 | 146.44 (17) | C44—P2—C38—C43 | −35.2 (5) |
P2—Ag1—P4—C56 | 23.66 (17) | C37—P2—C38—C43 | 71.9 (4) |
P1—Ag1—P4—C50 | 42.89 (17) | Ag1—P2—C38—C43 | −169.4 (4) |
P3—Ag1—P4—C50 | −88.92 (17) | C43—C38—C39—C40 | −1.0 (7) |
P2—Ag1—P4—C50 | 148.30 (17) | P2—C38—C39—C40 | 178.6 (4) |
P1—Ag1—P4—C62 | 162.07 (14) | C38—C39—C40—C41 | 1.9 (7) |
P3—Ag1—P4—C62 | 30.26 (14) | C39—C40—C41—C42 | −1.1 (7) |
P2—Ag1—P4—C62 | −92.52 (14) | C40—C41—C42—C43 | −0.5 (8) |
C13—Sn1—O1—C19 | 50.2 (3) | C41—C42—C43—C38 | 1.4 (9) |
C7—Sn1—O1—C19 | −67.4 (3) | C39—C38—C43—C42 | −0.7 (8) |
C1—Sn1—O1—C19 | 177.8 (3) | P2—C38—C43—C42 | 179.8 (4) |
C13—Sn1—O3—C21 | 67.1 (3) | C38—P2—C44—C45 | −71.1 (3) |
C7—Sn1—O3—C21 | −175.4 (3) | C37—P2—C44—C45 | −178.3 (3) |
C1—Sn1—O3—C21 | −60.2 (3) | Ag1—P2—C44—C45 | 58.6 (3) |
C13—Sn1—C1—C2 | 42.7 (4) | C38—P2—C44—C49 | 108.5 (3) |
C7—Sn1—C1—C2 | −135.7 (3) | C37—P2—C44—C49 | 1.3 (3) |
O3—Sn1—C1—C2 | 137.3 (3) | Ag1—P2—C44—C49 | −121.9 (3) |
O1—Sn1—C1—C2 | −41.7 (3) | C49—C44—C45—C46 | 0.1 (2) |
C13—Sn1—C1—C6 | −139.8 (3) | P2—C44—C45—C46 | 179.7 (3) |
C7—Sn1—C1—C6 | 41.9 (4) | C44—C45—C46—C47 | 0.2 (3) |
O3—Sn1—C1—C6 | −45.1 (3) | C45—C46—C47—C48 | −0.3 (5) |
O1—Sn1—C1—C6 | 135.8 (3) | C46—C47—C48—C49 | 0.2 (6) |
C6—C1—C2—C3 | 0.7 (6) | C47—C48—C49—C44 | 0.0 (6) |
Sn1—C1—C2—C3 | 178.2 (3) | C45—C44—C49—C48 | −0.2 (4) |
C1—C2—C3—C4 | −1.2 (7) | P2—C44—C49—C48 | −179.7 (3) |
C2—C3—C4—C5 | 0.4 (7) | C56—P4—C50—C55 | −27.5 (4) |
C3—C4—C5—C6 | 0.8 (7) | C62—P4—C50—C55 | 82.5 (4) |
C4—C5—C6—C1 | −1.4 (7) | Ag1—P4—C50—C55 | −155.6 (3) |
C2—C1—C6—C5 | 0.6 (6) | C56—P4—C50—C51 | 154.2 (3) |
Sn1—C1—C6—C5 | −177.0 (3) | C62—P4—C50—C51 | −95.8 (4) |
C13—Sn1—C7—C12 | 61.2 (4) | Ag1—P4—C50—C51 | 26.1 (4) |
C1—Sn1—C7—C12 | −120.2 (3) | C55—C50—C51—C52 | −1.3 (6) |
O3—Sn1—C7—C12 | −30.8 (3) | P4—C50—C51—C52 | 177.1 (3) |
O1—Sn1—C7—C12 | 152.7 (3) | C50—C51—C52—C53 | 0.9 (7) |
C13—Sn1—C7—C8 | −119.6 (3) | C51—C52—C53—C54 | −0.1 (7) |
C1—Sn1—C7—C8 | 58.9 (4) | C52—C53—C54—C55 | −0.4 (7) |
O3—Sn1—C7—C8 | 148.3 (3) | C51—C50—C55—C54 | 0.8 (6) |
O1—Sn1—C7—C8 | −28.2 (3) | P4—C50—C55—C54 | −177.5 (3) |
C12—C7—C8—C9 | 1.6 (6) | C53—C54—C55—C50 | 0.0 (7) |
Sn1—C7—C8—C9 | −177.5 (3) | C50—P4—C56—C61 | 112.9 (4) |
C7—C8—C9—C10 | −3.3 (7) | C62—P4—C56—C61 | 5.9 (4) |
C8—C9—C10—C11 | 1.8 (7) | Ag1—P4—C56—C61 | −111.5 (3) |
C9—C10—C11—C12 | 1.2 (7) | C50—P4—C56—C57 | −72.6 (3) |
C8—C7—C12—C11 | 1.5 (6) | C62—P4—C56—C57 | −179.7 (3) |
Sn1—C7—C12—C11 | −179.4 (3) | Ag1—P4—C56—C57 | 62.9 (3) |
C10—C11—C12—C7 | −2.9 (6) | C61—C56—C57—C58 | −1.1 (6) |
C7—Sn1—C13—C14 | 168.2 (3) | P4—C56—C57—C58 | −175.9 (3) |
C1—Sn1—C13—C14 | −10.1 (4) | C56—C57—C58—C59 | 1.5 (7) |
O3—Sn1—C13—C14 | −103.6 (4) | C57—C58—C59—C60 | −1.4 (7) |
O1—Sn1—C13—C14 | 72.4 (4) | C58—C59—C60—C61 | 0.8 (7) |
C7—Sn1—C13—C18 | −8.4 (4) | C57—C56—C61—C60 | 0.5 (6) |
C1—Sn1—C13—C18 | 173.3 (3) | P4—C56—C61—C60 | 174.9 (3) |
O3—Sn1—C13—C18 | 79.9 (4) | C59—C60—C61—C56 | −0.4 (7) |
O1—Sn1—C13—C18 | −104.2 (4) | C56—P4—C62—C63 | −178.9 (3) |
C18—C13—C14—C15 | 0.6 (7) | C50—P4—C62—C63 | 73.1 (3) |
Sn1—C13—C14—C15 | −176.0 (3) | Ag1—P4—C62—C63 | −59.2 (3) |
C13—C14—C15—C16 | 0.7 (7) | P4—C62—C63—C64 | 87.4 (4) |
C14—C15—C16—C17 | −1.7 (8) | C62—C63—C64—P3 | −77.9 (4) |
C15—C16—C17—C18 | 1.3 (8) | C65—P3—C64—C63 | 172.3 (3) |
C16—C17—C18—C13 | 0.1 (8) | C71—P3—C64—C63 | −79.7 (3) |
C14—C13—C18—C17 | −1.0 (7) | Ag1—P3—C64—C63 | 45.7 (3) |
Sn1—C13—C18—C17 | 175.8 (4) | C71—P3—C65—C70 | −159.1 (3) |
Sn1—O1—C19—O2 | 29.7 (6) | C64—P3—C65—C70 | −51.7 (4) |
Sn1—O1—C19—C20 | −149.2 (2) | Ag1—P3—C65—C70 | 71.8 (4) |
O2—C19—C20—F1 | 6.8 (5) | C71—P3—C65—C66 | 26.9 (4) |
O1—C19—C20—F1 | −174.1 (3) | C64—P3—C65—C66 | 134.3 (3) |
O2—C19—C20—F2 | 125.8 (4) | Ag1—P3—C65—C66 | −102.2 (3) |
O1—C19—C20—F2 | −55.1 (4) | C70—C65—C66—C67 | 1.6 (6) |
O2—C19—C20—Cl1 | −113.8 (4) | P3—C65—C66—C67 | 175.7 (3) |
O1—C19—C20—Cl1 | 65.3 (4) | C65—C66—C67—C68 | −1.4 (7) |
Sn1—O3—C21—O4 | −9.4 (6) | C66—C67—C68—C69 | 1.1 (7) |
Sn1—O3—C21—C22 | 171.0 (2) | C67—C68—C69—C70 | −1.0 (7) |
O4—C21—C22—F3 | −4.1 (6) | C66—C65—C70—C69 | −1.5 (7) |
O3—C21—C22—F3 | 175.5 (3) | P3—C65—C70—C69 | −175.8 (4) |
O4—C21—C22—F4 | −123.8 (4) | C68—C69—C70—C65 | 1.2 (7) |
O3—C21—C22—F4 | 55.8 (4) | C65—P3—C71—C76 | −129.0 (3) |
O4—C21—C22—Cl2 | 115.6 (4) | C64—P3—C71—C76 | 123.3 (3) |
O3—C21—C22—Cl2 | −64.8 (4) | Ag1—P3—C71—C76 | 0.6 (3) |
C29—P1—C23—C24 | −85.8 (4) | C65—P3—C71—C72 | 50.4 (3) |
C35—P1—C23—C24 | 165.2 (3) | C64—P3—C71—C72 | −57.3 (4) |
Ag1—P1—C23—C24 | 45.0 (4) | Ag1—P3—C71—C72 | 180.0 (3) |
C29—P1—C23—C28 | 91.3 (4) | C76—C71—C72—C73 | 0.5 (6) |
C35—P1—C23—C28 | −17.7 (4) | P3—C71—C72—C73 | −178.9 (3) |
Ag1—P1—C23—C28 | −137.9 (3) | C71—C72—C73—C74 | −1.5 (6) |
C28—C23—C24—C25 | −0.5 (7) | C72—C73—C74—C75 | 1.3 (6) |
P1—C23—C24—C25 | 176.7 (3) | C73—C74—C75—C76 | −0.2 (6) |
C23—C24—C25—C26 | 0.9 (7) | C72—C71—C76—C75 | 0.6 (6) |
C24—C25—C26—C27 | 0.0 (7) | P3—C71—C76—C75 | 180.0 (3) |
C25—C26—C27—C28 | −1.3 (7) | C74—C75—C76—C71 | −0.8 (6) |
Experimental details
Crystal data | |
Chemical formula | [Ag(C27H26P2)2][Sn(C6H5)3(C2ClF2O2)] |
Mr | 1541.64 |
Crystal system, space group | Triclinic, P1 |
Temperature (K) | 100 |
a, b, c (Å) | 10.5554 (2), 17.6600 (4), 19.1383 (4) |
α, β, γ (°) | 91.581 (1), 94.931 (1), 104.535 (1) |
V (Å3) | 3436.1 (1) |
Z | 2 |
Radiation type | Mo Kα |
µ (mm−1) | 0.88 |
Crystal size (mm) | 0.18 × 0.12 × 0.05 |
Data collection | |
Diffractometer | Bruker SMART APEX diffractometer |
Absorption correction | Multi-scan (SADABS; Sheldrick, 1996) |
Tmin, Tmax | 0.858, 0.957 |
No. of measured, independent and observed [I > 2σ(I)] reflections | 35712, 15398, 10993 |
Rint | 0.065 |
(sin θ/λ)max (Å−1) | 0.650 |
Refinement | |
R[F2 > 2σ(F2)], wR(F2), S | 0.049, 0.112, 1.05 |
No. of reflections | 15398 |
No. of parameters | 829 |
No. of restraints | 48 |
H-atom treatment | H-atom parameters constrained |
Δρmax, Δρmin (e Å−3) | 0.86, −0.76 |
Computer programs: APEX2 (Bruker, 2007), SAINT (Bruker, 2007), SHELXS97 (Sheldrick, 2008), SHELXL97 (Sheldrick, 2008), X-SEED (Barbour, 2001), publCIF (Westrip, 2008).
Acknowledgements
The authors thank the University of Malaya for funding this study (grant No. SF022155/2007 A) and also for the purchase of the diffractometer.
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The structural chemistry of di(carboxylato)triorganostannates has been reviewed by Tiekink (1991, 1994). This study continues our studies on bis(chlorodifluoroacetato)triorganostannates (Ng & Hook, 1999; Teo et al., 2004, 2007, 2008). One of these studies used the bis[1,3-bis(diphenylphosphine)ethane]silver cation as counterion. Herewith we present the crystal structure of the title compound, (I), where [Ag(Ph2(CH2)3Ph2)2] cation is the counterion for [SnPh3(ClF2CCO2)2] anion (Scheme I).
In (I) (Fig. 1), the silver(I) and tin(IV) atoms show tetrahedral and trans-trigonal bipyramidal coordinations, respectively.