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Information card for entry 4343272
Preview
Coordinates | 4343272.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C41 H34 B F20 Mo N O P2 |
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Calculated formula | C41 H34 B F20 Mo N O P2 |
SMILES | [MoH2]12345([P](CC)(CN(C[P]1(CC)CC)C)CC)([cH]1[cH]2[cH]3[cH]4[cH]51)C#[O].Fc1c(F)c(F)c(c(F)c1F)[B-](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F |
Title of publication | Molybdenum Hydride and Dihydride Complexes Bearing Diphosphine Ligands with a Pendant Amine: Formation of Complexes with Bound Amines. |
Authors of publication | Zhang, Shaoguang; Bullock, R. Morris |
Journal of publication | Inorganic chemistry |
Year of publication | 2015 |
Journal volume | 54 |
Journal issue | 13 |
Pages of publication | 6397 - 6409 |
a | 27.6682 ± 0.0019 Å |
b | 11.4434 ± 0.0007 Å |
c | 17.0104 ± 0.0013 Å |
α | 90° |
β | 126.648 ± 0.006° |
γ | 90° |
Cell volume | 4321.1 ± 0.6 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 8 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0477 |
Residual factor for significantly intense reflections | 0.0368 |
Weighted residual factors for significantly intense reflections | 0.0789 |
Weighted residual factors for all reflections included in the refinement | 0.0832 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
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/4343272.html
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