Information card for entry 7009451

Structure parameters

• Formula: C16 H18 As Mo2 O4 P
• Calculated formula: C16 H18 As Mo2 O4 P
• SMILES: [Mo]12345([As]([Mo]6789([PH2]1)(C#[O])(C#[O])[cH]1[cH]6[cH]7[cH]8[cH]91)(C)C)(C#[O])(C#[O])[cH]1[cH]2[cH]3[cH]4[cH]51
• Title of publication: The reactions of the anions [Cp2(CO)4Mo2(μ-PRR')]− (R, R' = H, Ph) towards chloroarsines and chlorophosphines; synthesis of complexes containing both bridging phosphido and arsenido groups
• Authors of publication: Davies, John E.; Feeder, Neil; Gray, Caspar A.; Mays, Martin J.; Woods, Anthony D.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 11
• Pages of publication: 1695
• a: 10.945 ± 0.004 Å
• b: 21.547 ± 0.006 Å
• c: 8.022 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1891.8 ± 1.5 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 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: 0.1658
• Residual factor for significantly intense reflections: 0.0811
• Weighted residual factors for significantly intense reflections: 0.1645
• Weighted residual factors for all reflections included in the refinement: 0.2039
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No