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Information card for entry 2006318
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Coordinates | 2006318.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | μ-bromo-μ-(pentacarbonylmanganese)phosphido-bis(tetracarbonylmanganese) |
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Formula | C13 H Br Mn3 O13 P |
Calculated formula | C13 H Br Mn3 O13 P |
SMILES | [Br]1[Mn]([PH]([Mn]1(C#[O])(C#[O])(C#[O])C#[O])[Mn](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | μ-Bromo-μ-cyclohexylphosphido-bis(tetracarbonylmanganese) and μ-Bromo-μ-(pentacarbonylmanganese)phosphido-bis(tetracarbonylmanganese) |
Authors of publication | Flörke, Ulrich; Haupt, Hans-Jürgen |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1997 |
Journal volume | 53 |
Journal issue | 7 |
Pages of publication | 876 - 879 |
a | 8.735 ± 0.002 Å |
b | 8.953 ± 0.001 Å |
c | 13.837 ± 0.004 Å |
α | 81.57 ± 0.02° |
β | 84.59 ± 0.02° |
γ | 74.68 ± 0.02° |
Cell volume | 1030.6 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0616 |
Residual factor for significantly intense reflections | 0.0398 |
Weighted residual factors for all reflections | 0.0951 |
Weighted residual factors for significantly intense reflections | 0.0861 |
Goodness-of-fit parameter for all reflections | 1.018 |
Goodness-of-fit parameter for significantly intense reflections | 1.067 |
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/2006318.html
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Users of the data should acknowledge the original authors of the
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