metal-organic compounds\(\def\hfill{\hskip 5em}\def\hfil{\hskip 3em}\def\eqno#1{\hfil {#1}}\)

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ISSN: 2056-9890

Tri­benzylbis(tri­phenyl­arsine oxide-κO)tin(IV) tetra­phenyl­borate

aDepartment of Chemistry, University of Malaya, 50603 Kuala Lumpur, Malaysia
*Correspondence e-mail: seikweng@um.edu.my

(Received 23 September 2010; accepted 2 October 2010; online 9 October 2010)

The crystal structure of the title salt, [Sn(C7H7)3(C18H15AsO)2][B(C6H5)4], consists of discrete cations and anions; the tin atom of the cation is five-coordinated in a distorted trans-C3SnO2 trigonal-bipyramidal geometry [summation of C–Sn–C angles 360.0 (3)° and O–Sn–O angle 173.1 (1)°]. The structure contains voids of 113 (19) Å3, but no solvent mol­ecule could reasonably be located there.

Related literature

For the structure of a related triorganotin tetra­phenyl­borate, see: Ng et al. (1989[Ng, W. K., Chen, W., Kumar Das, V. G. & Butcher, R. J. (1989). J. Organomet. Chem. 361, 53-61.]).

[Scheme 1]

Experimental

Crystal data
  • [Sn(C7H7)3(C18H15AsO)2](C24H20B)

  • Mr = 1355.72

  • Triclinic, [P \overline 1]

  • a = 14.3288 (7) Å

  • b = 14.9477 (7) Å

  • c = 19.0994 (9) Å

  • α = 69.220 (1)°

  • β = 73.972 (1)°

  • γ = 62.683 (1)°

  • V = 3366.4 (3) Å3

  • Z = 2

  • Mo Kα radiation

  • μ = 1.40 mm−1

  • T = 100 K

  • 0.1 × 0.1 × 0.1 mm

Data collection
  • Bruker SMART APEX diffractometer

  • Absorption correction: multi-scan (TWINABS; Bruker, 2009[Bruker (2009). APEX2, SAINT and TWINABS. Bruker AXS Inc., Madison, Wisconsin, USA.]) Tmin = 0.788, Tmax = 1.000

  • 76329 measured reflections

  • 17932 independent reflections

  • 12383 reflections with I > 2σ(I)

  • Rint = 0.068

Refinement
  • R[F2 > 2σ(F2)] = 0.050

  • wR(F2) = 0.170

  • S = 0.99

  • 17932 reflections

  • 629 parameters

  • H-atom parameters constrained

  • Δρmax = 2.06 e Å−3

  • Δρmin = −1.10 e Å−3

Table 1
Selected geometric parameters (Å, °)

Sn1—C1 2.150 (5)
Sn1—C8 2.145 (5)
Sn1—C15 2.144 (5)
Sn1—O1 2.175 (3)
Sn1—O2 2.225 (3)
C1—Sn1—C8 114.4 (2)
C1—Sn1—C15 119.7 (2)
C8—Sn1—C15 125.9 (2)
O1—Sn1—O2 173.1 (1)
As1—O1—Sn1 165.3 (2)
As2—O2—Sn1 160.3 (2)

Data collection: APEX2 (Bruker, 2009[Bruker (2009). APEX2, SAINT and TWINABS. Bruker AXS Inc., Madison, Wisconsin, USA.]); cell refinement: SAINT (Bruker, 2009[Bruker (2009). APEX2, SAINT and TWINABS. Bruker AXS Inc., Madison, Wisconsin, USA.]); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); molecular graphics: X-SEED (Barbour, 2001[Barbour, L. J. (2001). J. Supramol. Chem. 1, 189-191.]); software used to prepare material for publication: publCIF (Westrip, 2010[Westrip, S. P. (2010). J. Appl. Cryst. 43, 920-925.]).

Supporting information


Comment top

A suggestion for improving the aqueous solubility of triorganotin(IV) compounds, R3SnX, involves exchanging the X residue by the non-nucleophilic tetraphenylborate anion to generate a salt. However, to prevent aggregation into an oligopolymer, the triorganotin species itself must be stabilized by coordination by two neutral ligands. Of the number of such compounds synthesized, the crystal structure of only one, namely, [(p-ClC6H4)Ph2Sn(Ph3AsO)2][BPh4], has been reported (Ng et al., 1989). The compound exists as non-interacting cations and anions; the tin atom of the cation is five-coordinate in a trans-C3SnO2 trigonal bipyramidal geometry. The title tribenzyltin adduct (Scheme I, Figs. 1 & 2) is a similar non-interacting salt. The trans angle at tin is nearly linear, and the Sn–O–As skeleton is also nearly linear (Table 1).

Related literature top

For the structure of a related triorganotin tetraphenylborate, see: Ng et al. (1989).

Experimental top

Tribenzyltin chloride (0.21 g, 0.5 mmol), triphenylarsine oxide (0.32 g, 1 mmol) and sodium tetraphenylborate (0.17 g, 0.5 mmol) were dissolved in ethanol (100 ml). The solution was heated for an hour. Then the mixture was filtered and the filtrate evaporated at room temperature to obtain the colorless crystals.

Refinement top

Carbon-bound H-atoms were placed in calculated positions (C—H 0.95 Å) and were included in the refinement in the riding model approximation, with U(H) set to 1.2U(C). All aromatic rings were refined as rigid hexagons of 1.39 Å sides.

The final difference Fourier map had a high peak at 3.22 Å from H39 and hole at 0.83 Å from Sn1. The peak could not be refined as a water O atom, and is probably an artifical of twinning. The structure contains a voids of 113 (19) Å3, but no solvent molecule(s) could be located there reasonably.

Structure description top

A suggestion for improving the aqueous solubility of triorganotin(IV) compounds, R3SnX, involves exchanging the X residue by the non-nucleophilic tetraphenylborate anion to generate a salt. However, to prevent aggregation into an oligopolymer, the triorganotin species itself must be stabilized by coordination by two neutral ligands. Of the number of such compounds synthesized, the crystal structure of only one, namely, [(p-ClC6H4)Ph2Sn(Ph3AsO)2][BPh4], has been reported (Ng et al., 1989). The compound exists as non-interacting cations and anions; the tin atom of the cation is five-coordinate in a trans-C3SnO2 trigonal bipyramidal geometry. The title tribenzyltin adduct (Scheme I, Figs. 1 & 2) is a similar non-interacting salt. The trans angle at tin is nearly linear, and the Sn–O–As skeleton is also nearly linear (Table 1).

For the structure of a related triorganotin tetraphenylborate, see: Ng et al. (1989).

Computing details top

Data collection: APEX2 (Bruker, 2009); cell refinement: SAINT (Bruker, 2009); data reduction: SAINT (Bruker, 2009); 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, 2010).

Figures top
[Figure 1] Fig. 1. Thermal ellipsoid plot (Barbour, 2001) of the cation of [Sn(C7H7)3(C18H15AsO)2] [B(C6H5)4] at the 70% probability level; hydrogen atoms are drawn as spheres of arbitrary radius.
[Figure 2] Fig. 2. Thermal ellipsoid plot (Barbour, 2001) of the anion of [Sn(C7H7)3(C18H15AsO)2] [B(C6H5)4] at the 70% probability level; hydrogen atoms are drawn as spheres of arbitrary radius.
Tribenzylbis(triphenylarsine oxide-κO)tin(IV) tetraphenylborate top
Crystal data top
[Sn(C7H7)3(C18H15AsO)](C24H20B)Z = 2
Mr = 1355.72F(000) = 1388
Triclinic, P1Dx = 1.337 Mg m3
Hall symbol: -P 1Mo Kα radiation, λ = 0.71073 Å
a = 14.3288 (7) ÅCell parameters from 4476 reflections
b = 14.9477 (7) Åθ = 2.3–28.2°
c = 19.0994 (9) ŵ = 1.40 mm1
α = 69.220 (1)°T = 100 K
β = 73.972 (1)°Cube, colorless
γ = 62.683 (1)°0.1 × 0.1 × 0.1 mm
V = 3366.4 (3) Å3
Data collection top
Bruker SMART APEX
diffractometer
17932 independent reflections
Radiation source: fine-focus sealed tube12383 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.068
ω scansθmax = 27.5°, θmin = 1.2°
Absorption correction: multi-scan
(TWINABS; Bruker, 2009)
h = 1718
Tmin = 0.788, Tmax = 1.000k = 1719
76329 measured reflectionsl = 024
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.050Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.170H-atom parameters constrained
S = 0.99 w = 1/[σ2(Fo2) + (0.1059P)2]
where P = (Fo2 + 2Fc2)/3
17932 reflections(Δ/σ)max = 0.001
629 parametersΔρmax = 2.06 e Å3
0 restraintsΔρmin = 1.10 e Å3
Crystal data top
[Sn(C7H7)3(C18H15AsO)](C24H20B)γ = 62.683 (1)°
Mr = 1355.72V = 3366.4 (3) Å3
Triclinic, P1Z = 2
a = 14.3288 (7) ÅMo Kα radiation
b = 14.9477 (7) ŵ = 1.40 mm1
c = 19.0994 (9) ÅT = 100 K
α = 69.220 (1)°0.1 × 0.1 × 0.1 mm
β = 73.972 (1)°
Data collection top
Bruker SMART APEX
diffractometer
17932 independent reflections
Absorption correction: multi-scan
(TWINABS; Bruker, 2009)
12383 reflections with I > 2σ(I)
Tmin = 0.788, Tmax = 1.000Rint = 0.068
76329 measured reflections
Refinement top
R[F2 > 2σ(F2)] = 0.0500 restraints
wR(F2) = 0.170H-atom parameters constrained
S = 0.99Δρmax = 2.06 e Å3
17932 reflectionsΔρmin = 1.10 e Å3
629 parameters
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Sn10.68359 (3)0.68691 (2)0.973010 (17)0.01457 (9)
As10.58668 (4)0.62392 (4)1.18383 (3)0.01939 (13)
As20.77629 (4)0.73481 (4)0.76041 (3)0.01624 (12)
O10.6109 (3)0.6565 (3)1.09025 (18)0.0275 (9)
O20.7611 (3)0.6987 (3)0.85374 (18)0.0239 (8)
B10.8611 (5)0.8755 (5)0.3893 (3)0.0213 (12)
C10.6220 (5)0.8523 (4)0.9593 (3)0.0271 (12)
H1A0.64720.88620.90750.033*
H1B0.54360.88130.96520.033*
C20.6556 (3)0.8774 (3)1.01589 (17)0.0260 (12)
C30.5848 (2)0.9025 (3)1.07932 (19)0.0261 (12)
H30.51510.90591.08600.031*
C40.6159 (2)0.9228 (3)1.13289 (16)0.0298 (13)
H40.56750.93991.17620.036*
C50.7177 (3)0.9179 (3)1.12305 (18)0.0300 (13)
H50.73900.93171.15970.036*
C60.7885 (2)0.8927 (3)1.0596 (2)0.0324 (13)
H60.85820.88941.05290.039*
C70.7574 (2)0.8725 (3)1.00605 (16)0.0283 (12)
H70.80580.85530.96270.034*
C80.8415 (4)0.6017 (4)1.0023 (3)0.0193 (10)
H8A0.89030.62740.96130.023*
H8B0.84340.61501.04890.023*
C90.8804 (3)0.48387 (18)1.01481 (17)0.0211 (11)
C100.8659 (3)0.4197 (2)1.08652 (14)0.0295 (13)
H100.83470.44841.12870.035*
C110.8970 (3)0.3137 (2)1.09650 (15)0.0364 (14)
H110.88710.26981.14550.044*
C120.9425 (3)0.27177 (18)1.0348 (2)0.0321 (13)
H120.96380.19931.04160.038*
C130.9570 (3)0.3359 (2)0.96306 (16)0.0270 (12)
H130.98820.30730.92090.032*
C140.9259 (3)0.4420 (2)0.95308 (13)0.0233 (11)
H140.93580.48580.90410.028*
C150.5900 (4)0.6224 (4)0.9532 (3)0.0204 (10)
H15A0.59390.63640.89800.024*
H15B0.62080.54570.97470.024*
C160.4742 (2)0.6659 (3)0.98714 (18)0.0210 (11)
C170.4353 (3)0.6003 (2)1.04697 (19)0.0319 (13)
H170.48090.52951.06600.038*
C180.3298 (3)0.6384 (3)1.07905 (18)0.0447 (17)
H180.30320.59351.11990.054*
C190.2631 (2)0.7420 (3)1.0513 (2)0.0452 (17)
H190.19100.76801.07320.054*
C200.3020 (2)0.8076 (2)0.9914 (2)0.0382 (15)
H200.25640.87840.97250.046*
C210.4075 (3)0.7696 (2)0.95937 (16)0.0302 (13)
H210.43410.81440.91850.036*
C220.4714 (2)0.7369 (3)1.21711 (19)0.0233 (11)
C230.4759 (3)0.7645 (3)1.2780 (2)0.0311 (13)
H230.53790.72841.30210.037*
C240.3896 (3)0.8448 (3)1.3037 (2)0.0439 (16)
H240.39260.86371.34530.053*
C250.2988 (3)0.8977 (3)1.2684 (2)0.054 (2)
H250.23980.95261.28600.065*
C260.2943 (3)0.8701 (3)1.2075 (2)0.0545 (19)
H260.23220.90621.18350.065*
C270.3806 (3)0.7897 (3)1.18188 (19)0.0414 (15)
H270.37750.77091.14030.050*
C280.7089 (2)0.5866 (3)1.22728 (17)0.0220 (11)
C290.7405 (3)0.4986 (2)1.28777 (18)0.0271 (12)
H290.70030.45711.30860.032*
C300.8308 (3)0.4715 (2)1.31782 (16)0.0334 (14)
H300.85230.41141.35920.040*
C310.8896 (2)0.5323 (3)1.28739 (19)0.0302 (13)
H310.95130.51381.30790.036*
C320.8581 (3)0.6202 (3)1.22690 (18)0.0297 (13)
H320.89830.66181.20610.036*
C330.7678 (3)0.6474 (2)1.19685 (15)0.0236 (11)
H330.74620.70751.15550.028*
C340.5484 (3)0.5070 (2)1.22101 (19)0.0230 (11)
C350.6048 (3)0.4222 (3)1.19022 (19)0.0374 (14)
H350.65990.42411.14910.045*
C360.5808 (3)0.3347 (2)1.2196 (2)0.0441 (16)
H360.61940.27671.19860.053*
C370.5003 (3)0.3319 (3)1.2798 (2)0.0420 (16)
H370.48380.27211.29990.050*
C380.4438 (3)0.4167 (3)1.31061 (19)0.0428 (16)
H380.38880.41481.35180.051*
C390.4678 (3)0.5043 (2)1.2812 (2)0.0345 (14)
H390.42920.56221.30230.041*
C400.8874 (2)0.7819 (3)0.72386 (17)0.0203 (10)
C410.9008 (3)0.8327 (3)0.76640 (15)0.0293 (12)
H410.85620.84100.81280.035*
C420.9793 (3)0.8713 (3)0.74100 (19)0.0344 (14)
H420.98840.90610.77010.041*
C431.0445 (2)0.8591 (3)0.67305 (19)0.0308 (13)
H431.09820.88560.65570.037*
C441.0311 (3)0.8083 (3)0.63051 (15)0.0321 (13)
H441.07570.80000.58410.038*
C450.9526 (3)0.7696 (3)0.65592 (16)0.0257 (12)
H450.94350.73490.62680.031*
C460.8060 (3)0.61942 (19)0.72419 (16)0.0176 (10)
C470.8266 (3)0.5212 (2)0.77497 (12)0.0217 (11)
H470.82390.51260.82710.026*
C480.8510 (3)0.43569 (18)0.74944 (15)0.0254 (11)
H480.86510.36860.78410.030*
C490.8549 (3)0.4483 (2)0.67314 (17)0.0246 (11)
H490.87160.38990.65570.030*
C500.8344 (3)0.5465 (2)0.62236 (12)0.0253 (12)
H500.83700.55510.57020.030*
C510.8099 (3)0.63205 (18)0.64788 (14)0.0230 (11)
H510.79580.69920.61320.028*
C520.6509 (2)0.8450 (2)0.72226 (17)0.0182 (10)
C530.5530 (2)0.8515 (2)0.76437 (14)0.0231 (11)
H530.54950.80380.81270.028*
C540.46027 (19)0.9277 (3)0.73580 (17)0.0263 (12)
H540.39340.93210.76460.032*
C550.4654 (2)0.9974 (2)0.66512 (18)0.0274 (12)
H550.40201.04950.64560.033*
C560.5633 (3)0.9910 (2)0.62301 (14)0.0281 (12)
H560.56681.03870.57470.034*
C570.6561 (2)0.9148 (3)0.65158 (16)0.0225 (11)
H570.72300.91040.62280.027*
C580.9777 (2)0.7831 (2)0.41918 (18)0.0221 (11)
C591.0692 (3)0.8022 (2)0.39184 (17)0.0251 (11)
H591.06690.86540.35490.030*
C601.1642 (2)0.7287 (3)0.41855 (19)0.0301 (13)
H601.22680.74170.39990.036*
C611.1677 (2)0.6362 (2)0.47260 (19)0.0319 (13)
H611.23260.58600.49090.038*
C621.0762 (3)0.6172 (2)0.49995 (16)0.0270 (12)
H621.07850.55400.53690.032*
C630.9812 (2)0.6906 (2)0.47324 (17)0.0227 (11)
H630.91860.67760.49190.027*
C640.7728 (2)0.8193 (2)0.41460 (17)0.0193 (10)
C650.6996 (3)0.8321 (2)0.47932 (16)0.0221 (11)
H650.69830.87310.50810.027*
C660.6283 (2)0.7847 (3)0.50194 (15)0.0284 (12)
H660.57830.79350.54620.034*
C670.6303 (3)0.7246 (3)0.45982 (19)0.0303 (13)
H670.58160.69230.47530.036*
C680.7035 (3)0.7119 (3)0.39510 (19)0.0312 (13)
H680.70480.67080.36630.037*
C690.7747 (2)0.7592 (3)0.37248 (16)0.0268 (12)
H690.82470.75050.32820.032*
C700.8132 (2)0.9726 (2)0.43254 (17)0.0189 (10)
C710.7171 (2)1.0564 (2)0.41706 (17)0.0223 (11)
H710.67721.05760.38420.027*
C720.6794 (2)1.1384 (2)0.44967 (19)0.0278 (12)
H720.61371.19570.43910.033*
C730.7378 (3)1.1367 (2)0.49776 (18)0.0294 (13)
H730.71201.19280.52000.035*
C740.8339 (3)1.0529 (3)0.51324 (17)0.0294 (13)
H740.87381.05170.54610.035*
C750.8716 (2)0.9708 (2)0.48063 (18)0.0233 (11)
H750.93730.91350.49120.028*
C760.8834 (3)0.9200 (2)0.29298 (12)0.0216 (11)
C770.9541 (3)0.84763 (19)0.25304 (17)0.0276 (12)
H770.98790.77630.27920.033*
C780.9755 (3)0.8796 (2)0.17476 (17)0.0329 (14)
H781.02380.83010.14750.040*
C790.9261 (3)0.9839 (3)0.13641 (12)0.0314 (13)
H790.94071.00580.08290.038*
C800.8553 (3)1.05630 (19)0.17636 (16)0.0267 (12)
H800.82161.12760.15020.032*
C810.8340 (2)1.0244 (2)0.25464 (16)0.0210 (11)
H810.78561.07380.28190.025*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Sn10.01473 (17)0.01544 (17)0.01310 (16)0.00479 (13)0.00460 (12)0.00301 (13)
As10.0186 (3)0.0259 (3)0.0140 (3)0.0083 (2)0.0023 (2)0.0063 (2)
As20.0163 (3)0.0201 (3)0.0120 (2)0.0081 (2)0.00233 (19)0.0025 (2)
O10.030 (2)0.041 (2)0.0141 (18)0.0184 (19)0.0009 (15)0.0061 (17)
O20.025 (2)0.031 (2)0.0131 (17)0.0127 (17)0.0052 (15)0.0002 (15)
B10.028 (3)0.021 (3)0.018 (3)0.010 (3)0.007 (2)0.005 (2)
C10.030 (3)0.022 (3)0.028 (3)0.007 (2)0.009 (2)0.008 (2)
C20.026 (3)0.016 (3)0.033 (3)0.006 (2)0.007 (2)0.006 (2)
C30.021 (3)0.015 (3)0.037 (3)0.001 (2)0.011 (2)0.005 (2)
C40.035 (3)0.024 (3)0.033 (3)0.012 (3)0.001 (3)0.013 (2)
C50.037 (3)0.031 (3)0.034 (3)0.017 (3)0.009 (3)0.014 (3)
C60.026 (3)0.033 (3)0.047 (4)0.011 (3)0.009 (3)0.019 (3)
C70.026 (3)0.026 (3)0.033 (3)0.009 (2)0.001 (2)0.013 (2)
C80.017 (3)0.025 (3)0.018 (2)0.011 (2)0.006 (2)0.002 (2)
C90.018 (3)0.021 (3)0.019 (3)0.003 (2)0.008 (2)0.002 (2)
C100.022 (3)0.031 (3)0.023 (3)0.003 (2)0.002 (2)0.003 (2)
C110.034 (3)0.024 (3)0.036 (3)0.008 (3)0.000 (3)0.001 (3)
C120.028 (3)0.022 (3)0.040 (3)0.010 (2)0.003 (3)0.003 (3)
C130.023 (3)0.030 (3)0.032 (3)0.008 (2)0.005 (2)0.014 (2)
C140.022 (3)0.023 (3)0.020 (3)0.005 (2)0.009 (2)0.002 (2)
C150.020 (3)0.024 (3)0.020 (3)0.012 (2)0.002 (2)0.006 (2)
C160.021 (3)0.030 (3)0.020 (3)0.015 (2)0.004 (2)0.008 (2)
C170.039 (3)0.039 (3)0.026 (3)0.026 (3)0.007 (3)0.012 (3)
C180.044 (4)0.055 (4)0.045 (4)0.038 (4)0.019 (3)0.019 (3)
C190.020 (3)0.072 (5)0.059 (4)0.026 (3)0.009 (3)0.036 (4)
C200.022 (3)0.047 (4)0.043 (4)0.007 (3)0.011 (3)0.012 (3)
C210.031 (3)0.042 (3)0.021 (3)0.017 (3)0.004 (2)0.009 (3)
C220.024 (3)0.024 (3)0.021 (3)0.012 (2)0.002 (2)0.006 (2)
C230.035 (3)0.034 (3)0.029 (3)0.020 (3)0.003 (2)0.012 (3)
C240.050 (4)0.039 (4)0.042 (4)0.015 (3)0.007 (3)0.023 (3)
C250.055 (5)0.038 (4)0.053 (4)0.012 (4)0.013 (4)0.018 (3)
C260.027 (4)0.049 (4)0.064 (5)0.000 (3)0.005 (3)0.011 (4)
C270.037 (4)0.049 (4)0.035 (4)0.014 (3)0.005 (3)0.013 (3)
C280.023 (3)0.025 (3)0.019 (3)0.009 (2)0.003 (2)0.007 (2)
C290.033 (3)0.028 (3)0.025 (3)0.014 (3)0.006 (2)0.007 (2)
C300.026 (3)0.038 (3)0.027 (3)0.000 (3)0.016 (2)0.007 (3)
C310.017 (3)0.043 (3)0.029 (3)0.006 (3)0.006 (2)0.014 (3)
C320.029 (3)0.046 (4)0.022 (3)0.021 (3)0.002 (2)0.011 (3)
C330.031 (3)0.024 (3)0.016 (2)0.012 (2)0.002 (2)0.005 (2)
C340.022 (3)0.027 (3)0.020 (3)0.008 (2)0.006 (2)0.005 (2)
C350.037 (4)0.036 (3)0.037 (3)0.015 (3)0.003 (3)0.014 (3)
C360.051 (4)0.030 (3)0.053 (4)0.014 (3)0.008 (3)0.015 (3)
C370.051 (4)0.037 (4)0.045 (4)0.026 (3)0.009 (3)0.004 (3)
C380.045 (4)0.045 (4)0.038 (4)0.026 (3)0.005 (3)0.009 (3)
C390.034 (3)0.041 (4)0.034 (3)0.021 (3)0.006 (3)0.016 (3)
C400.020 (3)0.023 (3)0.016 (2)0.009 (2)0.006 (2)0.000 (2)
C410.032 (3)0.034 (3)0.024 (3)0.016 (3)0.001 (2)0.009 (2)
C420.037 (4)0.039 (3)0.038 (3)0.024 (3)0.013 (3)0.004 (3)
C430.029 (3)0.030 (3)0.031 (3)0.019 (3)0.015 (3)0.011 (2)
C440.033 (3)0.037 (3)0.024 (3)0.022 (3)0.002 (2)0.004 (2)
C450.024 (3)0.034 (3)0.021 (3)0.016 (2)0.002 (2)0.004 (2)
C460.020 (3)0.012 (2)0.021 (2)0.004 (2)0.011 (2)0.0016 (19)
C470.021 (3)0.027 (3)0.016 (2)0.010 (2)0.005 (2)0.002 (2)
C480.027 (3)0.021 (3)0.027 (3)0.012 (2)0.004 (2)0.002 (2)
C490.026 (3)0.024 (3)0.025 (3)0.011 (2)0.001 (2)0.009 (2)
C500.031 (3)0.028 (3)0.019 (3)0.013 (2)0.003 (2)0.006 (2)
C510.029 (3)0.024 (3)0.013 (2)0.012 (2)0.000 (2)0.003 (2)
C520.020 (3)0.016 (2)0.020 (2)0.004 (2)0.009 (2)0.006 (2)
C530.023 (3)0.022 (3)0.018 (3)0.005 (2)0.006 (2)0.002 (2)
C540.015 (3)0.034 (3)0.028 (3)0.007 (2)0.002 (2)0.012 (2)
C550.035 (3)0.017 (3)0.031 (3)0.002 (2)0.022 (3)0.006 (2)
C560.033 (3)0.026 (3)0.021 (3)0.013 (3)0.006 (2)0.002 (2)
C570.020 (3)0.023 (3)0.018 (3)0.008 (2)0.003 (2)0.001 (2)
C580.029 (3)0.022 (3)0.016 (2)0.008 (2)0.003 (2)0.008 (2)
C590.019 (3)0.028 (3)0.031 (3)0.011 (2)0.004 (2)0.010 (2)
C600.024 (3)0.038 (3)0.037 (3)0.013 (3)0.011 (2)0.014 (3)
C610.030 (3)0.035 (3)0.028 (3)0.002 (3)0.016 (3)0.010 (3)
C620.037 (3)0.030 (3)0.012 (2)0.011 (3)0.008 (2)0.002 (2)
C630.022 (3)0.028 (3)0.018 (3)0.009 (2)0.003 (2)0.007 (2)
C640.014 (2)0.019 (2)0.022 (3)0.002 (2)0.010 (2)0.003 (2)
C650.027 (3)0.023 (3)0.015 (2)0.011 (2)0.008 (2)0.002 (2)
C660.036 (3)0.034 (3)0.019 (3)0.020 (3)0.006 (2)0.000 (2)
C670.026 (3)0.028 (3)0.040 (3)0.017 (3)0.009 (3)0.002 (3)
C680.032 (3)0.034 (3)0.038 (3)0.015 (3)0.005 (3)0.019 (3)
C690.018 (3)0.029 (3)0.037 (3)0.009 (2)0.002 (2)0.015 (3)
C700.023 (3)0.023 (3)0.017 (2)0.017 (2)0.003 (2)0.002 (2)
C710.022 (3)0.030 (3)0.023 (3)0.016 (2)0.000 (2)0.011 (2)
C720.028 (3)0.026 (3)0.027 (3)0.009 (2)0.001 (2)0.009 (2)
C730.035 (3)0.038 (3)0.027 (3)0.025 (3)0.013 (2)0.020 (3)
C740.039 (3)0.035 (3)0.023 (3)0.024 (3)0.001 (2)0.008 (2)
C750.022 (3)0.032 (3)0.022 (3)0.018 (2)0.003 (2)0.006 (2)
C760.015 (3)0.026 (3)0.021 (3)0.003 (2)0.004 (2)0.010 (2)
C770.028 (3)0.025 (3)0.022 (3)0.005 (2)0.005 (2)0.005 (2)
C780.031 (3)0.045 (4)0.020 (3)0.010 (3)0.001 (2)0.014 (3)
C790.031 (3)0.051 (4)0.014 (3)0.023 (3)0.002 (2)0.003 (3)
C800.037 (3)0.028 (3)0.023 (3)0.019 (3)0.010 (2)0.002 (2)
C810.025 (3)0.019 (3)0.021 (3)0.008 (2)0.007 (2)0.005 (2)
Geometric parameters (Å, º) top
Sn1—C12.150 (5)C36—C371.3900
Sn1—C82.145 (5)C36—H360.9500
Sn1—C152.144 (5)C37—C381.3900
Sn1—O12.175 (3)C37—H370.9500
Sn1—O22.225 (3)C38—C391.3900
As1—O11.657 (3)C38—H380.9500
As1—C221.899 (3)C39—H390.9500
As1—C341.909 (3)C40—C411.3900
As1—C281.909 (2)C40—C451.3900
As2—O21.651 (3)C41—C421.3900
As2—C401.893 (2)C41—H410.9500
As2—C521.904 (2)C42—C431.3900
As2—C461.909 (2)C42—H420.9500
B1—C581.695 (6)C43—C441.3900
B1—C701.697 (6)C43—H430.9500
B1—C641.701 (6)C44—C451.3900
B1—C761.712 (6)C44—H440.9500
C1—C21.511 (5)C45—H450.9500
C1—H1A0.9900C46—C471.3900
C1—H1B0.9900C46—C511.3900
C2—C31.3900C47—C481.3900
C2—C71.3900C47—H470.9500
C3—C41.3900C48—C491.3900
C3—H30.9500C48—H480.9500
C4—C51.3900C49—C501.3900
C4—H40.9500C49—H490.9500
C5—C61.3900C50—C511.3900
C5—H50.9500C50—H500.9500
C6—C71.3900C51—H510.9500
C6—H60.9500C52—C531.3900
C7—H70.9500C52—C571.3900
C8—C91.531 (5)C53—C541.3900
C8—H8A0.9900C53—H530.9500
C8—H8B0.9900C54—C551.3900
C9—C101.3900C54—H540.9500
C9—C141.3900C55—C561.3900
C10—C111.3900C55—H550.9500
C10—H100.9500C56—C571.3900
C11—C121.3900C56—H560.9500
C11—H110.9500C57—H570.9500
C12—C131.3900C58—C591.3900
C12—H120.9500C58—C631.3900
C13—C141.3900C59—C601.3900
C13—H130.9500C59—H590.9500
C14—H140.9500C60—C611.3900
C15—C161.520 (5)C60—H600.9500
C15—H15A0.9900C61—C621.3900
C15—H15B0.9900C61—H610.9500
C16—C171.3900C62—C631.3900
C16—C211.3900C62—H620.9500
C17—C181.3900C63—H630.9500
C17—H170.9500C64—C651.3900
C18—C191.3900C64—C691.3900
C18—H180.9500C65—C661.3900
C19—C201.3900C65—H650.9500
C19—H190.9500C66—C671.3900
C20—C211.3900C66—H660.9500
C20—H200.9500C67—C681.3900
C21—H210.9500C67—H670.9500
C22—C231.3900C68—C691.3900
C22—C271.3900C68—H680.9500
C23—C241.3900C69—H690.9500
C23—H230.9500C70—C711.3900
C24—C251.3900C70—C751.3900
C24—H240.9500C71—C721.3900
C25—C261.3900C71—H710.9500
C25—H250.9500C72—C731.3900
C26—C271.3900C72—H720.9500
C26—H260.9500C73—C741.3900
C27—H270.9500C73—H730.9500
C28—C291.3900C74—C751.3900
C28—C331.3900C74—H740.9500
C29—C301.3900C75—H750.9500
C29—H290.9500C76—C771.3900
C30—C311.3900C76—C811.3900
C30—H300.9500C77—C781.3900
C31—C321.3900C77—H770.9500
C31—H310.9500C78—C791.3900
C32—C331.3900C78—H780.9500
C32—H320.9500C79—C801.3900
C33—H330.9500C79—H790.9500
C34—C351.3900C80—C811.3900
C34—C391.3900C80—H800.9500
C35—C361.3900C81—H810.9500
C35—H350.9500
C1—Sn1—C8114.4 (2)C34—C35—C36120.0
C1—Sn1—C15119.7 (2)C34—C35—H35120.0
C8—Sn1—C15125.9 (2)C36—C35—H35120.0
C15—Sn1—O186.24 (16)C35—C36—C37120.0
C8—Sn1—O193.12 (16)C35—C36—H36120.0
C1—Sn1—O193.11 (18)C37—C36—H36120.0
C15—Sn1—O288.98 (16)C38—C37—C36120.0
C8—Sn1—O285.65 (16)C38—C37—H37120.0
C1—Sn1—O293.57 (17)C36—C37—H37120.0
O1—Sn1—O2173.1 (1)C37—C38—C39120.0
O1—As1—C22109.92 (17)C37—C38—H38120.0
O1—As1—C34111.14 (16)C39—C38—H38120.0
C22—As1—C34107.37 (16)C38—C39—C34120.0
O1—As1—C28110.98 (16)C38—C39—H39120.0
C22—As1—C28109.80 (15)C34—C39—H39120.0
C34—As1—C28107.54 (15)C41—C40—C45120.0
O2—As2—C40109.27 (16)C41—C40—As2117.73 (17)
O2—As2—C52111.94 (16)C45—C40—As2122.25 (17)
C40—As2—C52108.31 (14)C40—C41—C42120.0
O2—As2—C46109.16 (15)C40—C41—H41120.0
C40—As2—C46111.20 (14)C42—C41—H41120.0
C52—As2—C46106.96 (14)C43—C42—C41120.0
As1—O1—Sn1165.3 (2)C43—C42—H42120.0
As2—O2—Sn1160.3 (2)C41—C42—H42120.0
C58—B1—C70109.7 (3)C44—C43—C42120.0
C58—B1—C64108.3 (4)C44—C43—H43120.0
C70—B1—C64108.3 (4)C42—C43—H43120.0
C58—B1—C76107.9 (4)C43—C44—C45120.0
C70—B1—C76112.3 (4)C43—C44—H44120.0
C64—B1—C76110.3 (3)C45—C44—H44120.0
C2—C1—Sn1112.2 (3)C44—C45—C40120.0
C2—C1—H1A109.2C44—C45—H45120.0
Sn1—C1—H1A109.2C40—C45—H45120.0
C2—C1—H1B109.2C47—C46—C51120.0
Sn1—C1—H1B109.2C47—C46—As2119.09 (16)
H1A—C1—H1B107.9C51—C46—As2120.89 (16)
C3—C2—C7120.0C46—C47—C48120.0
C3—C2—C1119.5 (3)C46—C47—H47120.0
C7—C2—C1120.5 (3)C48—C47—H47120.0
C4—C3—C2120.0C49—C48—C47120.0
C4—C3—H3120.0C49—C48—H48120.0
C2—C3—H3120.0C47—C48—H48120.0
C3—C4—C5120.0C50—C49—C48120.0
C3—C4—H4120.0C50—C49—H49120.0
C5—C4—H4120.0C48—C49—H49120.0
C4—C5—C6120.0C49—C50—C51120.0
C4—C5—H5120.0C49—C50—H50120.0
C6—C5—H5120.0C51—C50—H50120.0
C7—C6—C5120.0C50—C51—C46120.0
C7—C6—H6120.0C50—C51—H51120.0
C5—C6—H6120.0C46—C51—H51120.0
C6—C7—C2120.0C53—C52—C57120.0
C6—C7—H7120.0C53—C52—As2118.93 (17)
C2—C7—H7120.0C57—C52—As2120.97 (17)
C9—C8—Sn1112.6 (3)C52—C53—C54120.0
C9—C8—H8A109.1C52—C53—H53120.0
Sn1—C8—H8A109.1C54—C53—H53120.0
C9—C8—H8B109.1C53—C54—C55120.0
Sn1—C8—H8B109.1C53—C54—H54120.0
H8A—C8—H8B107.8C55—C54—H54120.0
C10—C9—C14120.0C56—C55—C54120.0
C10—C9—C8120.6 (3)C56—C55—H55120.0
C14—C9—C8119.3 (3)C54—C55—H55120.0
C11—C10—C9120.0C57—C56—C55120.0
C11—C10—H10120.0C57—C56—H56120.0
C9—C10—H10120.0C55—C56—H56120.0
C10—C11—C12120.0C56—C57—C52120.0
C10—C11—H11120.0C56—C57—H57120.0
C12—C11—H11120.0C52—C57—H57120.0
C13—C12—C11120.0C59—C58—C63120.0
C13—C12—H12120.0C59—C58—B1119.7 (3)
C11—C12—H12120.0C63—C58—B1120.3 (3)
C12—C13—C14120.0C60—C59—C58120.0
C12—C13—H13120.0C60—C59—H59120.0
C14—C13—H13120.0C58—C59—H59120.0
C13—C14—C9120.0C59—C60—C61120.0
C13—C14—H14120.0C59—C60—H60120.0
C9—C14—H14120.0C61—C60—H60120.0
C16—C15—Sn1113.7 (3)C62—C61—C60120.0
C16—C15—H15A108.8C62—C61—H61120.0
Sn1—C15—H15A108.8C60—C61—H61120.0
C16—C15—H15B108.8C61—C62—C63120.0
Sn1—C15—H15B108.8C61—C62—H62120.0
H15A—C15—H15B107.7C63—C62—H62120.0
C17—C16—C21120.0C62—C63—C58120.0
C17—C16—C15118.9 (3)C62—C63—H63120.0
C21—C16—C15121.1 (3)C58—C63—H63120.0
C18—C17—C16120.0C65—C64—C69120.0
C18—C17—H17120.0C65—C64—B1119.1 (3)
C16—C17—H17120.0C69—C64—B1120.9 (3)
C17—C18—C19120.0C66—C65—C64120.0
C17—C18—H18120.0C66—C65—H65120.0
C19—C18—H18120.0C64—C65—H65120.0
C20—C19—C18120.0C65—C66—C67120.0
C20—C19—H19120.0C65—C66—H66120.0
C18—C19—H19120.0C67—C66—H66120.0
C21—C20—C19120.0C68—C67—C66120.0
C21—C20—H20120.0C68—C67—H67120.0
C19—C20—H20120.0C66—C67—H67120.0
C20—C21—C16120.0C67—C68—C69120.0
C20—C21—H21120.0C67—C68—H68120.0
C16—C21—H21120.0C69—C68—H68120.0
C23—C22—C27120.0C68—C69—C64120.0
C23—C22—As1120.4 (2)C68—C69—H69120.0
C27—C22—As1119.5 (2)C64—C69—H69120.0
C22—C23—C24120.0C71—C70—C75120.0
C22—C23—H23120.0C71—C70—B1119.6 (3)
C24—C23—H23120.0C75—C70—B1120.4 (3)
C23—C24—C25120.0C72—C71—C70120.0
C23—C24—H24120.0C72—C71—H71120.0
C25—C24—H24120.0C70—C71—H71120.0
C26—C25—C24120.0C71—C72—C73120.0
C26—C25—H25120.0C71—C72—H72120.0
C24—C25—H25120.0C73—C72—H72120.0
C25—C26—C27120.0C72—C73—C74120.0
C25—C26—H26120.0C72—C73—H73120.0
C27—C26—H26120.0C74—C73—H73120.0
C26—C27—C22120.0C75—C74—C73120.0
C26—C27—H27120.0C75—C74—H74120.0
C22—C27—H27120.0C73—C74—H74120.0
C29—C28—C33120.0C74—C75—C70120.0
C29—C28—As1120.76 (18)C74—C75—H75120.0
C33—C28—As1119.23 (18)C70—C75—H75120.0
C30—C29—C28120.0C77—C76—C81120.0
C30—C29—H29120.0C77—C76—B1117.6 (3)
C28—C29—H29120.0C81—C76—B1122.4 (3)
C29—C30—C31120.0C76—C77—C78120.0
C29—C30—H30120.0C76—C77—H77120.0
C31—C30—H30120.0C78—C77—H77120.0
C32—C31—C30120.0C77—C78—C79120.0
C32—C31—H31120.0C77—C78—H78120.0
C30—C31—H31120.0C79—C78—H78120.0
C31—C32—C33120.0C78—C79—C80120.0
C31—C32—H32120.0C78—C79—H79120.0
C33—C32—H32120.0C80—C79—H79120.0
C32—C33—C28120.0C81—C80—C79120.0
C32—C33—H33120.0C81—C80—H80120.0
C28—C33—H33120.0C79—C80—H80120.0
C35—C34—C39120.0C80—C81—C76120.0
C35—C34—As1119.74 (19)C80—C81—H81120.0
C39—C34—As1120.18 (19)C76—C81—H81120.0
C22—As1—O1—Sn1126.5 (9)C52—As2—C40—C4188.5 (2)
C34—As1—O1—Sn1114.8 (9)C46—As2—C40—C41154.27 (18)
C28—As1—O1—Sn14.8 (9)O2—As2—C40—C45148.1 (2)
C15—Sn1—O1—As1139.5 (9)C52—As2—C40—C4589.7 (2)
C8—Sn1—O1—As113.6 (9)C46—As2—C40—C4527.6 (2)
C1—Sn1—O1—As1101.0 (9)C45—C40—C41—C420.0
C40—As2—O2—Sn1128.4 (6)As2—C40—C41—C42178.2 (2)
C52—As2—O2—Sn18.4 (7)C40—C41—C42—C430.0
C46—As2—O2—Sn1109.8 (6)C41—C42—C43—C440.0
C15—Sn1—O2—As262.7 (6)C42—C43—C44—C450.0
C8—Sn1—O2—As2171.2 (6)C43—C44—C45—C400.0
C1—Sn1—O2—As257.0 (6)C41—C40—C45—C440.0
C15—Sn1—C1—C2144.6 (3)As2—C40—C45—C44178.1 (3)
C8—Sn1—C1—C237.7 (4)O2—As2—C46—C479.3 (2)
O1—Sn1—C1—C257.2 (4)C40—As2—C46—C47111.3 (2)
O2—Sn1—C1—C2124.5 (3)C52—As2—C46—C47130.62 (19)
Sn1—C1—C2—C3100.8 (3)O2—As2—C46—C51172.3 (2)
Sn1—C1—C2—C777.3 (4)C40—As2—C46—C5167.0 (2)
C7—C2—C3—C40.0C52—As2—C46—C5151.0 (2)
C1—C2—C3—C4178.1 (4)C51—C46—C47—C480.0
C2—C3—C4—C50.0As2—C46—C47—C48178.4 (2)
C3—C4—C5—C60.0C46—C47—C48—C490.0
C4—C5—C6—C70.0C47—C48—C49—C500.0
C5—C6—C7—C20.0C48—C49—C50—C510.0
C3—C2—C7—C60.0C49—C50—C51—C460.0
C1—C2—C7—C6178.1 (4)C47—C46—C51—C500.0
C15—Sn1—C8—C94.9 (4)As2—C46—C51—C50178.3 (2)
C1—Sn1—C8—C9177.5 (3)O2—As2—C52—C5330.3 (2)
O1—Sn1—C8—C982.7 (3)C40—As2—C52—C53150.86 (18)
O2—Sn1—C8—C990.5 (3)C46—As2—C52—C5389.19 (19)
Sn1—C8—C9—C1091.8 (3)O2—As2—C52—C57153.30 (19)
Sn1—C8—C9—C1485.1 (3)C40—As2—C52—C5732.8 (2)
C14—C9—C10—C110.0C46—As2—C52—C5787.2 (2)
C8—C9—C10—C11176.9 (4)C57—C52—C53—C540.0
C9—C10—C11—C120.0As2—C52—C53—C54176.4 (2)
C10—C11—C12—C130.0C52—C53—C54—C550.0
C11—C12—C13—C140.0C53—C54—C55—C560.0
C12—C13—C14—C90.0C54—C55—C56—C570.0
C10—C9—C14—C130.0C55—C56—C57—C520.0
C8—C9—C14—C13176.9 (3)C53—C52—C57—C560.0
C8—Sn1—C15—C16138.9 (3)As2—C52—C57—C56176.3 (2)
C1—Sn1—C15—C1643.7 (4)C70—B1—C58—C5975.9 (4)
O1—Sn1—C15—C1647.7 (3)C64—B1—C58—C59166.1 (2)
O2—Sn1—C15—C16137.2 (3)C76—B1—C58—C5946.7 (4)
Sn1—C15—C16—C17112.3 (3)C70—B1—C58—C63101.3 (4)
Sn1—C15—C16—C2167.6 (4)C64—B1—C58—C6316.7 (4)
C21—C16—C17—C180.0C76—B1—C58—C63136.1 (3)
C15—C16—C17—C18179.9 (3)C63—C58—C59—C600.0
C16—C17—C18—C190.0B1—C58—C59—C60177.2 (3)
C17—C18—C19—C200.0C58—C59—C60—C610.0
C18—C19—C20—C210.0C59—C60—C61—C620.0
C19—C20—C21—C160.0C60—C61—C62—C630.0
C17—C16—C21—C200.0C61—C62—C63—C580.0
C15—C16—C21—C20179.9 (3)C59—C58—C63—C620.0
O1—As1—C22—C23136.7 (2)B1—C58—C63—C62177.1 (3)
C34—As1—C22—C23102.3 (2)C58—B1—C64—C6598.9 (3)
C28—As1—C22—C2314.4 (3)C70—B1—C64—C6520.0 (4)
O1—As1—C22—C2745.6 (3)C76—B1—C64—C65143.3 (3)
C34—As1—C22—C2775.4 (2)C58—B1—C64—C6979.6 (4)
C28—As1—C22—C27167.9 (2)C70—B1—C64—C69161.5 (3)
C27—C22—C23—C240.0C76—B1—C64—C6938.2 (4)
As1—C22—C23—C24177.7 (3)C69—C64—C65—C660.0
C22—C23—C24—C250.0B1—C64—C65—C66178.5 (3)
C23—C24—C25—C260.0C64—C65—C66—C670.0
C24—C25—C26—C270.0C65—C66—C67—C680.0
C25—C26—C27—C220.0C66—C67—C68—C690.0
C23—C22—C27—C260.0C67—C68—C69—C640.0
As1—C22—C27—C26177.7 (3)C65—C64—C69—C680.0
O1—As1—C28—C29135.3 (2)B1—C64—C69—C68178.5 (3)
C22—As1—C28—C29103.0 (2)C58—B1—C70—C71179.2 (3)
C34—As1—C28—C2913.5 (2)C64—B1—C70—C7161.2 (4)
O1—As1—C28—C3343.5 (2)C76—B1—C70—C7160.9 (4)
C22—As1—C28—C3378.2 (2)C58—B1—C70—C753.6 (5)
C34—As1—C28—C33165.30 (19)C64—B1—C70—C75121.6 (3)
C33—C28—C29—C300.0C76—B1—C70—C75116.3 (3)
As1—C28—C29—C30178.8 (2)C75—C70—C71—C720.0
C28—C29—C30—C310.0B1—C70—C71—C72177.2 (3)
C29—C30—C31—C320.0C70—C71—C72—C730.0
C30—C31—C32—C330.0C71—C72—C73—C740.0
C31—C32—C33—C280.0C72—C73—C74—C750.0
C29—C28—C33—C320.0C73—C74—C75—C700.0
As1—C28—C33—C32178.8 (2)C71—C70—C75—C740.0
O1—As1—C34—C3543.5 (3)B1—C70—C75—C74177.2 (3)
C22—As1—C34—C35163.8 (2)C58—B1—C76—C7737.5 (4)
C28—As1—C34—C3578.1 (2)C70—B1—C76—C77158.5 (3)
O1—As1—C34—C39139.7 (2)C64—B1—C76—C7780.6 (4)
C22—As1—C34—C3919.5 (3)C58—B1—C76—C81142.3 (3)
C28—As1—C34—C3998.6 (2)C70—B1—C76—C8121.3 (5)
C39—C34—C35—C360.0C64—B1—C76—C8199.7 (4)
As1—C34—C35—C36176.7 (3)C81—C76—C77—C780.0
C34—C35—C36—C370.0B1—C76—C77—C78179.7 (4)
C35—C36—C37—C380.0C76—C77—C78—C790.0
C36—C37—C38—C390.0C77—C78—C79—C800.0
C37—C38—C39—C340.0C78—C79—C80—C810.0
C35—C34—C39—C380.0C79—C80—C81—C760.0
As1—C34—C39—C38176.7 (3)C77—C76—C81—C800.0
O2—As2—C40—C4133.7 (2)B1—C76—C81—C80179.7 (4)

Experimental details

Crystal data
Chemical formula[Sn(C7H7)3(C18H15AsO)](C24H20B)
Mr1355.72
Crystal system, space groupTriclinic, P1
Temperature (K)100
a, b, c (Å)14.3288 (7), 14.9477 (7), 19.0994 (9)
α, β, γ (°)69.220 (1), 73.972 (1), 62.683 (1)
V3)3366.4 (3)
Z2
Radiation typeMo Kα
µ (mm1)1.40
Crystal size (mm)0.1 × 0.1 × 0.1
Data collection
DiffractometerBruker SMART APEX
diffractometer
Absorption correctionMulti-scan
(TWINABS; Bruker, 2009)
Tmin, Tmax0.788, 1.000
No. of measured, independent and
observed [I > 2σ(I)] reflections
76329, 17932, 12383
Rint0.068
(sin θ/λ)max1)0.650
Refinement
R[F2 > 2σ(F2)], wR(F2), S 0.050, 0.170, 0.99
No. of reflections17932
No. of parameters629
H-atom treatmentH-atom parameters constrained
Δρmax, Δρmin (e Å3)2.06, 1.10

Computer programs: APEX2 (Bruker, 2009), SAINT (Bruker, 2009), SHELXS97 (Sheldrick, 2008), SHELXL97 (Sheldrick, 2008), X-SEED (Barbour, 2001), publCIF (Westrip, 2010).

Selected geometric parameters (Å, º) top
Sn1—C12.150 (5)Sn1—O12.175 (3)
Sn1—C82.145 (5)Sn1—O22.225 (3)
Sn1—C152.144 (5)
C1—Sn1—C8114.4 (2)O1—Sn1—O2173.1 (1)
C1—Sn1—C15119.7 (2)As1—O1—Sn1165.3 (2)
C8—Sn1—C15125.9 (2)As2—O2—Sn1160.3 (2)
 

Acknowledgements

We thank the University of Malaya (RG020/00AFr) for supporting this study.

References

First citationBarbour, L. J. (2001). J. Supramol. Chem. 1, 189–191.  CrossRef CAS Google Scholar
First citationBruker (2009). APEX2, SAINT and TWINABS. Bruker AXS Inc., Madison, Wisconsin, USA.  Google Scholar
First citationNg, W. K., Chen, W., Kumar Das, V. G. & Butcher, R. J. (1989). J. Organomet. Chem. 361, 53–61.  CAS Google Scholar
First citationSheldrick, G. M. (2008). Acta Cryst. A64, 112–122.  Web of Science CrossRef CAS IUCr Journals Google Scholar
First citationWestrip, S. P. (2010). J. Appl. Cryst. 43, 920–925.  Web of Science CrossRef CAS IUCr Journals Google Scholar

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