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Information card for entry 4122206
Preview
Coordinates | 4122206.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C50 H34 F6 O9 P2 S2 |
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Calculated formula | C50 H34 F6 O9 P2 S2 |
SMILES | P(=O)(c1cccc2c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3c3c(OS(=O)(=O)C(F)(F)F)cccc3c3cccc(OS(=O)(=O)C(F)(F)F)c3c12)(c1ccccc1)c1ccccc1.O |
Title of publication | Chiral rodlike platinum complexes, double helical chains, and potential asymmetric hydrogenation ligand based on "linear" building blocks: 1,8,9,16-tetrahydroxytetraphenylene and 1,8,9,16-tetrakis(diphenylphosphino)tetraphenylene. |
Authors of publication | Peng, Hai-Yan; Lam, Chi-Keung; Mak, Thomas C. W.; Cai, Zongwei; Ma, Wai-Tang; Li, Yu-Xue; Wong, Henry N. C. |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2005 |
Journal volume | 127 |
Journal issue | 26 |
Pages of publication | 9603 - 9611 |
a | 10.3423 ± 0.0006 Å |
b | 29.4187 ± 0.0017 Å |
c | 15.2361 ± 0.0009 Å |
α | 90° |
β | 96.53 ± 0.001° |
γ | 90° |
Cell volume | 4605.6 ± 0.5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0787 |
Residual factor for significantly intense reflections | 0.0478 |
Weighted residual factors for significantly intense reflections | 0.0956 |
Weighted residual factors for all reflections included in the refinement | 0.104 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.891 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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