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Information card for entry 4105825
Preview
Coordinates | 4105825.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | bis(mu-3-N,N'-diphenylhydrazido)N,N'diphenylhydrazidobis(mu-phenylamido) tetrapyridinetetramanganese(II) |
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Formula | C83 H77 Mn4 N15 |
Calculated formula | C83 H77 Mn4 N15 |
SMILES | [Mn]123([N]4(c5ccccc5)[Mn]5([NH](c6ccccc6)[Mn]([N]3([N]25c2ccccc2)c2ccccc2)(N(N([Mn]([NH]1c1ccccc1)(N4c1ccccc1)[n]1ccccc1)c1ccccc1)c1ccccc1)[n]1ccccc1)[n]1ccccc1)[n]1ccccc1.n1ccccc1.n1ccccc1.n1ccccc1 |
Title of publication | Synthesis of Tetranuclear, Four-Coordinate Manganese Clusters with "Pinned Butterfly" Geometry Formed by Metal-Mediated N-N Bond Cleavage in Diphenylhydrazine |
Authors of publication | Clifton R. Hamilton; Regina A. Baglia; Alexander D. Gordon; Michael J. Zdilla |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2011 |
Journal volume | 133 |
Pages of publication | 4208 - 4211 |
a | 22.764 ± 0.003 Å |
b | 14.0803 ± 0.0016 Å |
c | 24.148 ± 0.003 Å |
α | 90° |
β | 109.392 ± 0.002° |
γ | 90° |
Cell volume | 7300.9 ± 1.6 Å3 |
Cell temperature | 115 ± 2 K |
Ambient diffraction temperature | 115 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0709 |
Residual factor for significantly intense reflections | 0.0401 |
Weighted residual factors for significantly intense reflections | 0.0898 |
Weighted residual factors for all reflections included in the refinement | 0.102 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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