Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536803028162/cv6253sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536803028162/cv6253Isup2.hkl |
CCDC reference: 231822
Key indicators
- Single-crystal X-ray study
- T = 293 K
- Mean (C-C) = 0.005 Å
- R factor = 0.027
- wR factor = 0.041
- Data-to-parameter ratio = 26.2
checkCIF/PLATON results
No syntax errors found
Alert level A PLAT029_ALERT_3_A _diffrn_measured_fraction_theta_full Low ....... 0.91
Alert level C REFLT03_ALERT_3_C Reflection count < 95% complete From the CIF: _diffrn_reflns_theta_max 31.81 From the CIF: _diffrn_reflns_theta_full 0.00 From the CIF: _reflns_number_total 8500 TEST2: Reflns within _diffrn_reflns_theta_max Count of symmetry unique reflns 9384 Completeness (_total/calc) 90.58% PLAT125_ALERT_4_C No _symmetry_space_group_name_Hall Given ....... ? PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 2.71 Ratio PLAT230_ALERT_2_C Hirshfeld Test Diff for C44 - C45 = 6.18 su PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Pt1 - C1 = 5.19 su PLAT241_ALERT_2_C Check High U(eq) as Compared to Neighbors .... C33 PLAT242_ALERT_2_C Check Low U(eq) as Compared to Neighbors .... C31 PLAT331_ALERT_2_C Small Av. Phenyl C-C Dist. C41 - C46 = 1.37 Ang.
1 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 8 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 6 ALERT type 2 Indicator that the structure model may be wrong or deficient 2 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion
Data collection: SMART (Siemens, 1995); cell refinement: SAINT (Siemens, 1995); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97; molecular graphics: DIAMOND (Brandenburg, 1999); software used to prepare material for publication: SHELXL97.
[PtCl(C32H27P2)] | F(000) = 1376 |
Mr = 704.02 | Dx = 1.704 Mg m−3 |
Monoclinic, P21/n | Mo Kα radiation, λ = 0.71073 Å |
a = 10.290 (2) Å | Cell parameters from 6134 reflections |
b = 16.117 (3) Å | θ = 2.4–24.8° |
c = 17.173 (3) Å | µ = 5.35 mm−1 |
β = 105.47 (3)° | T = 293 K |
V = 2744.8 (10) Å3 | Prism, yellow |
Z = 4 | 0.25 × 0.20 × 0.12 mm |
Siemens SMART CCD diffractometer | 8500 independent reflections |
Radiation source: rotating anode | 4739 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.049 |
Detector resolution: 512 pixels mm-1 | θmax = 31.8°, θmin = 1.8° |
ω scans | h = −14→13 |
Absorption correction: multi-scan (SADABS; Sheldrick, 1996) | k = −22→22 |
Tmin = 0.312, Tmax = 0.526 | l = −25→25 |
27382 measured reflections |
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)] = 0.027 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.041 | H-atom parameters constrained |
S = 0.91 | w = 1/[σ2(Fo2) + (0.0001P)2] where P = (Fo2 + 2Fc2)/3 |
8500 reflections | (Δ/σ)max = 0.004 |
325 parameters | Δρmax = 0.77 e Å−3 |
0 restraints | Δρmin = −1.10 e Å−3 |
Experimental. Data was collected with a SMART CCD system using ω-scan, -0.2° and 10 s per frame. The detector distance was set to 4.0 cm. The data have a completeness of more then 99% out to θ=29.3°. The structure was solved by direct methods and refined by full matrix least squares methods. Scattering factors, dispersion corrections and absorption coefficients were taken from International Tables for Crystallography, Vol. C. (1992), tables 6.1.1.4, 4.2.6.8 and 4.2.4.2 respectively. |
Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes. |
Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger. |
x | y | z | Uiso*/Ueq | ||
Pt1 | 0.996496 (13) | 0.202660 (8) | 0.969368 (8) | 0.03471 (4) | |
P2 | 0.94856 (9) | 0.24827 (6) | 1.08397 (5) | 0.0381 (2) | |
P1 | 1.09047 (9) | 0.13474 (5) | 0.88138 (5) | 0.0378 (2) | |
Cl1 | 0.84548 (8) | 0.29183 (6) | 0.87706 (5) | 0.0543 (2) | |
C1 | 1.1193 (3) | 0.12616 (18) | 1.04738 (18) | 0.0352 (8) | |
C2 | 1.1704 (3) | 0.05328 (19) | 1.02204 (18) | 0.0368 (8) | |
C3 | 1.2464 (4) | −0.0025 (2) | 1.0770 (2) | 0.0519 (10) | |
H3 | 1.2761 | −0.0516 | 1.0589 | 0.062* | |
C4 | 1.2780 (4) | 0.0147 (2) | 1.1588 (2) | 0.0554 (11) | |
H4 | 1.3300 | −0.0227 | 1.1955 | 0.066* | |
C5 | 1.2335 (3) | 0.0861 (2) | 1.1864 (2) | 0.0486 (9) | |
H5 | 1.2557 | 0.0973 | 1.2415 | 0.058* | |
C6 | 1.1555 (3) | 0.1415 (2) | 1.1322 (2) | 0.0399 (8) | |
C7 | 1.1343 (3) | 0.03528 (19) | 0.93244 (18) | 0.0422 (9) | |
H7A | 1.0585 | −0.0026 | 0.9177 | 0.051* | |
H7B | 1.2102 | 0.0105 | 0.9176 | 0.051* | |
C8 | 1.1034 (3) | 0.22054 (19) | 1.16107 (18) | 0.0465 (9) | |
H8A | 1.1697 | 0.2645 | 1.1671 | 0.056* | |
H8B | 1.0844 | 0.2116 | 1.2128 | 0.056* | |
C11 | 1.0091 (3) | 0.1156 (2) | 0.77538 (19) | 0.0432 (9) | |
C12 | 0.9816 (4) | 0.0367 (2) | 0.7431 (2) | 0.0655 (12) | |
H12 | 1.0037 | −0.0094 | 0.7767 | 0.079* | |
C13 | 0.9217 (4) | 0.0256 (3) | 0.6614 (2) | 0.0764 (13) | |
H13 | 0.9024 | −0.0277 | 0.6408 | 0.092* | |
C14 | 0.8910 (4) | 0.0921 (3) | 0.6110 (2) | 0.0746 (13) | |
H14 | 0.8514 | 0.0843 | 0.5561 | 0.090* | |
C15 | 0.9185 (4) | 0.1704 (3) | 0.6412 (2) | 0.0709 (13) | |
H15 | 0.8994 | 0.2159 | 0.6068 | 0.085* | |
C16 | 0.9749 (4) | 0.1821 (2) | 0.7231 (2) | 0.0577 (11) | |
H16 | 0.9900 | 0.2357 | 0.7434 | 0.069* | |
C21 | 1.2506 (3) | 0.1803 (2) | 0.87760 (19) | 0.0392 (9) | |
C22 | 1.2910 (4) | 0.2563 (2) | 0.9154 (2) | 0.0502 (10) | |
H22 | 1.2363 | 0.2835 | 0.9424 | 0.060* | |
C23 | 1.4125 (4) | 0.2910 (3) | 0.9126 (2) | 0.0686 (11) | |
H23 | 1.4395 | 0.3413 | 0.9384 | 0.082* | |
C24 | 1.4937 (4) | 0.2523 (3) | 0.8723 (2) | 0.0691 (13) | |
H24 | 1.5744 | 0.2768 | 0.8700 | 0.083* | |
C25 | 1.4565 (4) | 0.1784 (3) | 0.8358 (2) | 0.0718 (14) | |
H25 | 1.5127 | 0.1523 | 0.8090 | 0.086* | |
C26 | 1.3353 (4) | 0.1409 (2) | 0.8376 (2) | 0.0569 (11) | |
H26 | 1.3110 | 0.0900 | 0.8124 | 0.068* | |
C31 | 0.9186 (4) | 0.3577 (2) | 1.09825 (19) | 0.0452 (9) | |
C32 | 0.8006 (4) | 0.3873 (3) | 1.1112 (2) | 0.0725 (13) | |
H32 | 0.7316 | 0.3512 | 1.1143 | 0.087* | |
C33 | 0.7873 (5) | 0.4717 (3) | 1.1196 (3) | 0.0958 (17) | |
H33 | 0.7065 | 0.4922 | 1.1262 | 0.115* | |
C34 | 0.8884 (5) | 0.5262 (3) | 1.1185 (2) | 0.0773 (14) | |
H34 | 0.8785 | 0.5825 | 1.1276 | 0.093* | |
C35 | 1.0028 (5) | 0.4973 (2) | 1.1042 (3) | 0.0775 (14) | |
H35 | 1.0707 | 0.5340 | 1.1006 | 0.093* | |
C36 | 1.0193 (4) | 0.4126 (2) | 1.0948 (2) | 0.0741 (13) | |
H36 | 1.0992 | 0.3928 | 1.0860 | 0.089* | |
C41 | 0.8107 (3) | 0.19309 (19) | 1.10800 (19) | 0.0381 (8) | |
C42 | 0.8153 (4) | 0.1666 (2) | 1.1852 (2) | 0.0649 (12) | |
H42 | 0.8919 | 0.1754 | 1.2276 | 0.078* | |
C43 | 0.7032 (5) | 0.1263 (3) | 1.1985 (3) | 0.0846 (15) | |
H43 | 0.7060 | 0.1082 | 1.2503 | 0.102* | |
C44 | 0.5905 (4) | 0.1129 (3) | 1.1380 (3) | 0.0789 (14) | |
H44 | 0.5165 | 0.0863 | 1.1481 | 0.095* | |
C45 | 0.5870 (4) | 0.1389 (2) | 1.0625 (3) | 0.0648 (12) | |
H45 | 0.5102 | 0.1300 | 1.0203 | 0.078* | |
C46 | 0.6954 (4) | 0.1779 (2) | 1.0481 (2) | 0.0536 (10) | |
H46 | 0.6911 | 0.1949 | 0.9957 | 0.064* |
U11 | U22 | U33 | U12 | U13 | U23 | |
Pt1 | 0.03778 (8) | 0.03177 (7) | 0.03718 (7) | −0.00009 (8) | 0.01454 (5) | −0.00031 (7) |
P2 | 0.0431 (6) | 0.0339 (5) | 0.0389 (5) | 0.0034 (4) | 0.0137 (4) | −0.0029 (4) |
P1 | 0.0425 (6) | 0.0351 (5) | 0.0396 (5) | 0.0003 (4) | 0.0177 (4) | −0.0014 (4) |
Cl1 | 0.0525 (6) | 0.0542 (6) | 0.0552 (5) | 0.0119 (5) | 0.0125 (4) | 0.0155 (5) |
C1 | 0.036 (2) | 0.0293 (18) | 0.046 (2) | −0.0030 (16) | 0.0197 (16) | −0.0075 (15) |
C2 | 0.041 (2) | 0.0335 (19) | 0.040 (2) | 0.0015 (17) | 0.0178 (17) | 0.0045 (16) |
C3 | 0.066 (3) | 0.041 (2) | 0.054 (2) | 0.0122 (19) | 0.024 (2) | 0.0066 (18) |
C4 | 0.067 (3) | 0.049 (2) | 0.048 (2) | 0.018 (2) | 0.013 (2) | 0.0182 (19) |
C5 | 0.055 (3) | 0.049 (2) | 0.039 (2) | 0.008 (2) | 0.0090 (18) | 0.0031 (18) |
C6 | 0.033 (2) | 0.039 (2) | 0.047 (2) | −0.0006 (17) | 0.0109 (17) | −0.0056 (17) |
C7 | 0.045 (2) | 0.033 (2) | 0.051 (2) | 0.0008 (16) | 0.0168 (18) | 0.0002 (16) |
C8 | 0.049 (2) | 0.045 (2) | 0.043 (2) | 0.0030 (18) | 0.0075 (17) | −0.0077 (16) |
C11 | 0.042 (2) | 0.049 (2) | 0.042 (2) | −0.0097 (18) | 0.0188 (17) | −0.0055 (18) |
C12 | 0.088 (3) | 0.057 (3) | 0.054 (3) | −0.010 (2) | 0.023 (2) | −0.006 (2) |
C13 | 0.097 (4) | 0.081 (3) | 0.050 (3) | −0.018 (3) | 0.019 (3) | −0.027 (3) |
C14 | 0.059 (3) | 0.119 (4) | 0.043 (3) | −0.005 (3) | 0.007 (2) | −0.008 (3) |
C15 | 0.070 (3) | 0.090 (4) | 0.047 (3) | −0.001 (3) | 0.006 (2) | 0.008 (2) |
C16 | 0.065 (3) | 0.053 (3) | 0.053 (3) | −0.001 (2) | 0.012 (2) | 0.002 (2) |
C21 | 0.036 (2) | 0.047 (2) | 0.035 (2) | 0.0026 (17) | 0.0098 (16) | 0.0072 (16) |
C22 | 0.049 (3) | 0.055 (2) | 0.049 (2) | −0.010 (2) | 0.0176 (19) | 0.0037 (18) |
C23 | 0.059 (3) | 0.080 (3) | 0.061 (3) | −0.020 (3) | 0.006 (2) | 0.009 (2) |
C24 | 0.042 (3) | 0.099 (4) | 0.063 (3) | −0.007 (3) | 0.009 (2) | 0.030 (3) |
C25 | 0.059 (3) | 0.099 (4) | 0.072 (3) | 0.023 (3) | 0.042 (3) | 0.033 (3) |
C26 | 0.059 (3) | 0.062 (3) | 0.057 (3) | 0.009 (2) | 0.027 (2) | 0.006 (2) |
C31 | 0.062 (3) | 0.037 (2) | 0.040 (2) | 0.0001 (19) | 0.0190 (19) | −0.0021 (16) |
C32 | 0.068 (3) | 0.051 (3) | 0.117 (4) | 0.012 (2) | 0.057 (3) | 0.005 (3) |
C33 | 0.115 (4) | 0.059 (3) | 0.142 (5) | 0.023 (3) | 0.084 (4) | −0.002 (3) |
C34 | 0.124 (5) | 0.044 (3) | 0.075 (3) | 0.013 (3) | 0.046 (3) | −0.005 (2) |
C35 | 0.102 (4) | 0.039 (3) | 0.100 (4) | −0.014 (3) | 0.043 (3) | −0.005 (2) |
C36 | 0.074 (3) | 0.046 (3) | 0.113 (4) | −0.010 (2) | 0.043 (3) | −0.014 (2) |
C41 | 0.050 (2) | 0.0289 (19) | 0.038 (2) | 0.0006 (18) | 0.0175 (17) | −0.0025 (16) |
C42 | 0.089 (4) | 0.064 (3) | 0.046 (3) | −0.025 (2) | 0.025 (2) | −0.011 (2) |
C43 | 0.127 (5) | 0.081 (3) | 0.061 (3) | −0.027 (3) | 0.050 (3) | 0.005 (3) |
C44 | 0.076 (4) | 0.068 (3) | 0.108 (4) | −0.022 (3) | 0.050 (3) | −0.012 (3) |
C45 | 0.044 (3) | 0.076 (3) | 0.075 (3) | −0.007 (2) | 0.016 (2) | 0.011 (2) |
C46 | 0.047 (3) | 0.058 (3) | 0.058 (3) | 0.004 (2) | 0.019 (2) | 0.0084 (19) |
Pt1—C1 | 2.002 (3) | C16—H16 | 0.9300 |
Pt1—P2 | 2.2749 (10) | C21—C22 | 1.397 (4) |
Pt1—P1 | 2.2794 (9) | C21—C26 | 1.398 (4) |
Pt1—Cl1 | 2.3831 (10) | C22—C23 | 1.382 (4) |
P2—C41 | 1.812 (3) | C22—H22 | 0.9300 |
P2—C31 | 1.819 (3) | C23—C24 | 1.368 (5) |
P2—C8 | 1.835 (3) | C23—H23 | 0.9300 |
P1—C11 | 1.816 (3) | C24—C25 | 1.352 (5) |
P1—C21 | 1.821 (3) | C24—H24 | 0.9300 |
P1—C7 | 1.825 (3) | C25—C26 | 1.394 (5) |
C1—C2 | 1.403 (4) | C25—H25 | 0.9300 |
C1—C6 | 1.426 (4) | C26—H26 | 0.9300 |
C2—C3 | 1.385 (4) | C31—C36 | 1.375 (4) |
C2—C7 | 1.511 (4) | C31—C32 | 1.377 (4) |
C3—C4 | 1.384 (4) | C32—C33 | 1.378 (5) |
C3—H3 | 0.9300 | C32—H32 | 0.9300 |
C4—C5 | 1.370 (4) | C33—C34 | 1.366 (5) |
C4—H4 | 0.9300 | C33—H33 | 0.9300 |
C5—C6 | 1.381 (4) | C34—C35 | 1.349 (5) |
C5—H5 | 0.9300 | C34—H34 | 0.9300 |
C6—C8 | 1.515 (4) | C35—C36 | 1.391 (5) |
C7—H7A | 0.9700 | C35—H35 | 0.9300 |
C7—H7B | 0.9700 | C36—H36 | 0.9300 |
C8—H8A | 0.9700 | C41—C46 | 1.369 (4) |
C8—H8B | 0.9700 | C41—C42 | 1.381 (4) |
C11—C16 | 1.382 (4) | C42—C43 | 1.395 (5) |
C11—C12 | 1.385 (5) | C42—H42 | 0.9300 |
C12—C13 | 1.385 (5) | C43—C44 | 1.352 (5) |
C12—H12 | 0.9300 | C43—H43 | 0.9300 |
C13—C14 | 1.361 (5) | C44—C45 | 1.353 (5) |
C13—H13 | 0.9300 | C44—H44 | 0.9300 |
C14—C15 | 1.364 (5) | C45—C46 | 1.359 (4) |
C14—H14 | 0.9300 | C45—H45 | 0.9300 |
C15—C16 | 1.384 (5) | C46—H46 | 0.9300 |
C15—H15 | 0.9300 | ||
C1—Pt1—P2 | 82.18 (9) | C14—C15—C16 | 120.0 (4) |
C1—Pt1—P1 | 81.04 (9) | C14—C15—H15 | 120.0 |
P2—Pt1—P1 | 163.11 (3) | C16—C15—H15 | 120.0 |
C1—Pt1—Cl1 | 178.53 (9) | C11—C16—C15 | 121.3 (4) |
P2—Pt1—Cl1 | 97.31 (4) | C11—C16—H16 | 119.3 |
P1—Pt1—Cl1 | 99.51 (3) | C15—C16—H16 | 119.3 |
C41—P2—C31 | 105.93 (16) | C22—C21—C26 | 118.6 (3) |
C41—P2—C8 | 107.33 (16) | C22—C21—P1 | 119.8 (3) |
C31—P2—C8 | 106.54 (15) | C26—C21—P1 | 121.6 (3) |
C41—P2—Pt1 | 113.69 (11) | C23—C22—C21 | 119.9 (4) |
C31—P2—Pt1 | 120.91 (11) | C23—C22—H22 | 120.0 |
C8—P2—Pt1 | 101.46 (11) | C21—C22—H22 | 120.0 |
C11—P1—C21 | 102.28 (15) | C24—C23—C22 | 120.9 (4) |
C11—P1—C7 | 108.71 (16) | C24—C23—H23 | 119.6 |
C21—P1—C7 | 105.15 (15) | C22—C23—H23 | 119.6 |
C11—P1—Pt1 | 125.62 (11) | C25—C24—C23 | 120.0 (4) |
C21—P1—Pt1 | 112.21 (11) | C25—C24—H24 | 120.0 |
C7—P1—Pt1 | 101.39 (10) | C23—C24—H24 | 120.0 |
C2—C1—C6 | 116.4 (3) | C24—C25—C26 | 121.0 (4) |
C2—C1—Pt1 | 122.0 (2) | C24—C25—H25 | 119.5 |
C6—C1—Pt1 | 121.5 (2) | C26—C25—H25 | 119.5 |
C3—C2—C1 | 121.5 (3) | C25—C26—C21 | 119.5 (4) |
C3—C2—C7 | 120.7 (3) | C25—C26—H26 | 120.2 |
C1—C2—C7 | 117.8 (3) | C21—C26—H26 | 120.2 |
C4—C3—C2 | 119.9 (3) | C36—C31—C32 | 119.5 (3) |
C4—C3—H3 | 120.0 | C36—C31—P2 | 117.4 (3) |
C2—C3—H3 | 120.0 | C32—C31—P2 | 123.1 (3) |
C5—C4—C3 | 120.7 (3) | C31—C32—C33 | 118.3 (4) |
C5—C4—H4 | 119.7 | C31—C32—H32 | 120.8 |
C3—C4—H4 | 119.7 | C33—C32—H32 | 120.8 |
C4—C5—C6 | 119.9 (3) | C34—C33—C32 | 122.5 (4) |
C4—C5—H5 | 120.0 | C34—C33—H33 | 118.8 |
C6—C5—H5 | 120.0 | C32—C33—H33 | 118.8 |
C5—C6—C1 | 121.5 (3) | C35—C34—C33 | 119.0 (4) |
C5—C6—C8 | 121.1 (3) | C35—C34—H34 | 120.5 |
C1—C6—C8 | 117.4 (3) | C33—C34—H34 | 120.5 |
C2—C7—P1 | 106.4 (2) | C34—C35—C36 | 120.1 (4) |
C2—C7—H7A | 110.4 | C34—C35—H35 | 120.0 |
P1—C7—H7A | 110.4 | C36—C35—H35 | 120.0 |
C2—C7—H7B | 110.4 | C31—C36—C35 | 120.6 (4) |
P1—C7—H7B | 110.4 | C31—C36—H36 | 119.7 |
H7A—C7—H7B | 108.6 | C35—C36—H36 | 119.7 |
C6—C8—P2 | 106.5 (2) | C46—C41—C42 | 117.8 (3) |
C6—C8—H8A | 110.4 | C46—C41—P2 | 119.4 (3) |
P2—C8—H8A | 110.4 | C42—C41—P2 | 122.8 (3) |
C6—C8—H8B | 110.4 | C41—C42—C43 | 118.9 (4) |
P2—C8—H8B | 110.4 | C41—C42—H42 | 120.6 |
H8A—C8—H8B | 108.6 | C43—C42—H42 | 120.6 |
C16—C11—C12 | 117.5 (3) | C44—C43—C42 | 121.7 (4) |
C16—C11—P1 | 119.2 (3) | C44—C43—H43 | 119.1 |
C12—C11—P1 | 123.2 (3) | C42—C43—H43 | 119.1 |
C13—C12—C11 | 120.8 (4) | C43—C44—C45 | 119.0 (4) |
C13—C12—H12 | 119.6 | C43—C44—H44 | 120.5 |
C11—C12—H12 | 119.6 | C45—C44—H44 | 120.5 |
C14—C13—C12 | 120.5 (4) | C44—C45—C46 | 120.3 (4) |
C14—C13—H13 | 119.7 | C44—C45—H45 | 119.9 |
C12—C13—H13 | 119.7 | C46—C45—H45 | 119.9 |
C13—C14—C15 | 119.8 (4) | C45—C46—C41 | 122.3 (4) |
C13—C14—H14 | 120.1 | C45—C46—H46 | 118.9 |
C15—C14—H14 | 120.1 | C41—C46—H46 | 118.9 |
Subscribe to Acta Crystallographica Section E: Crystallographic Communications
The full text of this article is available to subscribers to the journal.
- Information on subscribing
- Sample issue
- If you have already subscribed, you may need to register