Information card for entry 7015009

Structure parameters

• Formula: C19 H25 Mo O6 P Si2
• Calculated formula: C19 H25 Mo O6 P Si2
• SMILES: C1(c2ccccc2)O[P]1(C([Si](C)(C)C)[Si](C)(C)C)[Mo](C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: First examples of oxaphosphirane pentacarbonylchromium(0) and -molybdenum(0) complexes: synthesis, structures and reactions
• Authors of publication: Albrecht, Carolin; Bode, Maren; Pérez, Janaina Marinas; Daniels, Jörg; Schnakenburg, Gregor; Streubel, Rainer
• Journal of publication: Dalton Transactions
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 11
• Pages of publication: 2654
• a: 8.8987 ± 0.0002 Å
• b: 10.6956 ± 0.0003 Å
• c: 13.9288 ± 0.0005 Å
• α: 87.1032 ± 0.0012°
• β: 88.3077 ± 0.0013°
• γ: 68.9673 ± 0.0017°
• Cell volume: 1235.7 ± 0.06 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0715
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0549
• Weighted residual factors for all reflections included in the refinement: 0.0606
• Goodness-of-fit parameter for all reflections included in the refinement: 0.886
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No