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Information card for entry 4314141
Preview
Coordinates | 4314141.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C82 H60 Cr2 Fe N2 O10 P4 Te2 |
---|---|
Calculated formula | C82 H60 Cr2 Fe N2 O10 P4 Te2 |
SMILES | [Te]12[Fe]([Te]3[Cr]14([Cr]23(C4=O)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O].P(=N[P+](c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.P(=N[P+](c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | The Unusual Paramagnetic Mixed-Metal Carbonyl Chalcogenide Clusters: [E2Cr2Fe(CO)10]2- (E = Te, Se) |
Authors of publication | Minghuey Shieh; Ren-Ling Chung; Chun-Hsien Yu; Miao-Hsing Hsu; Chia-Hua Ho; Shie-Ming Peng; Yi-Hung Liu |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 5477 - 5479 |
a | 12.7126 ± 0.0002 Å |
b | 16.3892 ± 0.0001 Å |
c | 20.7383 ± 0.0004 Å |
α | 71.109 ± 0.001° |
β | 75.33 ± 0.001° |
γ | 70.505 ± 0.001° |
Cell volume | 3802.3 ± 0.1 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1641 |
Residual factor for significantly intense reflections | 0.0821 |
Weighted residual factors for all reflections | 0.2541 |
Weighted residual factors for significantly intense reflections | 0.2063 |
Goodness-of-fit parameter for all reflections | 0.996 |
Goodness-of-fit parameter for significantly intense reflections | 1.187 |
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/4314141.html
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