Information card for entry 4342399

Structure parameters

• Formula: C30 H35 Co2 Mo2 O7 P3
• Calculated formula: C30 H35 Co2 Mo2 O7 P3
• SMILES: [Mo]123456([P](C7CCCCC7)(C7CCCCC7)[Mo]789%10%11([P]1%12(C)[Co]1%13([Co]%12([P]27%13)(C1=O)(C#[O])C#[O])(C#[O])C#[O])(C#[O])[cH]1[cH]%11[cH]8[cH]9[cH]%101)(C#[O])[cH]1[cH]5[cH]6[cH]3[cH]41
• Title of publication: Tetranuclear Phosphide- and Phosphinidene-Bridged Derivatives of the Diphosphenyl Complex [Mo2Cp2(μ-PCy2)(μ-κ(2):κ(2)-P2Me)(CO)2].
• Authors of publication: Alvarez, M. Angeles; García, M Esther; Lozano, Raquel; Ramos, Alberto; Ruiz, Miguel A.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 5
• Pages of publication: 2455
• a: 11.7503 ± 0.0003 Å
• b: 17.2964 ± 0.0004 Å
• c: 18.4643 ± 0.0005 Å
• α: 90°
• β: 118.712 ± 0.002°
• γ: 90°
• Cell volume: 3291.24 ± 0.16 ų
• Cell temperature: 123 ± 0.1 K
• Ambient diffraction temperature: 123 ± 0.1 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: 0.04
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.086
• Weighted residual factors for all reflections included in the refinement: 0.091
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No