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Information card for entry 4314305
Preview
Coordinates | 4314305.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C17 H10 Mn2 Mo2 O7 Se4 |
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Calculated formula | C17 H10 Mn2 Mo2 O7 Se4 |
SMILES | [Mn]1([Se]2[Mo]3456789([Se]%10[Mn]([Se]6[Mo]236%10%11%12%13([Se]14)[cH]1[cH]%13[cH]%11[cH]%12[cH]16)(C#[O])(C#[O])C#[O])[cH]1[cH]7[cH]8[cH]9[cH]15)(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | Syntheses and Reactivity of the Diselenido Molybdenum-Manganese Complex CpMoMn(CO)5(μ-Se2) |
Authors of publication | Richard D. Adams; O-Sung Kwon |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 6175 - 6182 |
a | 6.905 ± 0.0005 Å |
b | 14.6015 ± 0.0009 Å |
c | 23.5023 ± 0.0015 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2369.6 ± 0.3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0547 |
Residual factor for significantly intense reflections | 0.0452 |
Weighted residual factors for significantly intense reflections | 0.1027 |
Weighted residual factors for all reflections included in the refinement | 0.1074 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4314305.html
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