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Information card for entry 2017643
Preview
Coordinates | 2017643.cif |
---|---|
Structure factors | 2017643.hkl |
Original IUCr paper | HTML |
Chemical name | [μ-4,5-Bis(diphenylphosphino)-9,9- dimethylxanthene]bis[(trifluoroacetato)gold(I)] dichloromethane 0.58-solvate |
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Formula | C43.58 H33.16 Au2 Cl1.15 F6 O5 P2 |
Calculated formula | C43 H32 Au2 F6 O5 P2 |
SMILES | [Au]1([Au]([P](c2cccc3C(c4cccc([P]1(c1ccccc1)c1ccccc1)c4Oc23)(C)C)(c1ccccc1)c1ccccc1)OC(=O)C(F)(F)F)OC(=O)C(F)(F)F |
Title of publication | [μ-4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene]bis[(trifluoroacetato)gold(I)] and its dichloromethane 0.58-solvate |
Authors of publication | Tunyogi, Tünde; Deák, Andrea |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2010 |
Journal volume | 66 |
Journal issue | 5 |
Pages of publication | m133 - m136 |
a | 10.548 ± 0.003 Å |
b | 17.028 ± 0.004 Å |
c | 24.724 ± 0.007 Å |
α | 90° |
β | 100.253 ± 0.011° |
γ | 90° |
Cell volume | 4370 ± 2 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0451 |
Residual factor for significantly intense reflections | 0.0365 |
Weighted residual factors for significantly intense reflections | 0.0893 |
Weighted residual factors for all reflections included in the refinement | 0.0924 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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The link is: https://www.crystallography.net/2017643.html
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