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Information card for entry 4313121
Preview
Coordinates | 4313121.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H25 Mo N O3 P2 |
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Calculated formula | C30 H25 Mo N O3 P2 |
SMILES | [Mo]1([P](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)([N]#CC)(C#[O])(C#[O])C#[O] |
Title of publication | Syntheses, Reactivity, and Crystal Structures of Molybdenum Complexes with Pyridine-2-thionate (pyS)-Containing Ligands: Crystal Structures of [Mo(η3-C3H5)(CO)2]2(μ-η1,η2-pyS)2, exo-[Mo(η3-C3H5)(CO)(η2-pyS)(η2-dppe)], [Mo(CO)3(η1-SC5H4NH)(η2-dppm)], and [Mo(CO)(η2-pyS)2(η2-dppm)] |
Authors of publication | Kuang-Hway Yih; Gene-Hsiang Lee; Yu Wang |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 1092 - 1100 |
a | 10.93 ± 0.002 Å |
b | 18.516 ± 0.004 Å |
c | 15.173 ± 0.003 Å |
α | 90° |
β | 109.07 ± 0.02° |
γ | 90° |
Cell volume | 2902.2 ± 1.1 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 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 | 0.1301 |
Residual factor for significantly intense reflections | 0.0473 |
Weighted residual factors for significantly intense reflections | 0.0767 |
Weighted residual factors for all reflections included in the refinement | 0.0902 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
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/4313121.html
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Users of the data should acknowledge the original authors of the
structural data.