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Information card for entry 1564140
Preview
Coordinates | 1564140.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C82 H76 Cl4 O2 P6 Pt2 |
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Calculated formula | C82 H76 Cl4 O2 P6 Pt2 |
SMILES | C(#[O])[Pt]1([P](CC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[P](CC[P]([Pt]1(C#[O])[P](CC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.ClCCl.ClCCl |
Title of publication | Further insights into platinum carbonyl Chini clusters |
Authors of publication | Berti, Beatrice; Bortoluzzi, Marco; Ceriotti, Alessandro; Cesari, Cristiana; Femoni, Cristina; Carmela Iapalucci, Maria; Zacchini, Stefano |
Journal of publication | Inorganica Chimica Acta |
Year of publication | 2020 |
Journal volume | 512 |
Pages of publication | 119904 |
a | 15.2489 ± 0.0018 Å |
b | 12.6172 ± 0.0015 Å |
c | 20.066 ± 0.003 Å |
α | 90° |
β | 102.271 ± 0.004° |
γ | 90° |
Cell volume | 3772.5 ± 0.8 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0643 |
Residual factor for significantly intense reflections | 0.0551 |
Weighted residual factors for significantly intense reflections | 0.1189 |
Weighted residual factors for all reflections included in the refinement | 0.123 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.166 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1564140.html
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Users of the data should acknowledge the original authors of the
structural data.