Information card for entry 4077789

Structure parameters

• Formula: C12 H20 Mo O3 Si2
• Calculated formula: C12 H20 Mo O3 Si2
• SMILES: [Mo]12345([Si]([O](C)[Si]1(C)C)(C)C)(C#[O])(C#[O])[cH]1[cH]2[cH]3[cH]4[cH]51
• Title of publication: Synthesis, Crystal Structures, and Fluxional Behavior of Donor-Bridged Bis(silylene)molybdenum and -chromium Complexes
• Authors of publication: Ueno, Keiji; Masuko, Akira; Ogino, Hiroshi
• Journal of publication: Organometallics
• Year of publication: 1999
• Journal volume: 18
• Journal issue: 14
• Pages of publication: 2694
• a: 15.0938 ± 0.0013 Å
• b: 12.068 ± 0.0009 Å
• c: 9.0823 ± 0.0007 Å
• α: 90°
• β: 95.89 ± 0.02°
• γ: 90°
• Cell volume: 1645.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0605
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for all reflections: 0.094
• Weighted residual factors for significantly intense reflections: 0.0835
• Goodness-of-fit parameter for all reflections: 1.052
• Goodness-of-fit parameter for significantly intense reflections: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No