Information card for entry 4071246

Structure parameters

• Formula: C11 H12 Ge Mo O3
• Calculated formula: C11 H12 Ge Mo O3
• SMILES: [Mo]12345([c]6([Ge](C5)(C)C)[cH]1[cH]2[cH]3[cH]46)(C#[O])(C#[O])C#[O]
• Title of publication: The Chloromethylgermyl Complexes (η5-C5H5)M(CO)nGeR2CH2Cl [M = Fe (n= 2), Mo, W (n= 3)]: Rearrangements, Transformations to 1-Germa-3-metallacyclobutanes (η5-C5H4)M(CO)nCH2GeR2, and their Ring-Opening Polymerizations
• Authors of publication: Apodaca, Paula; Kumar, Mukesh; Cervantes-Lee, Francisco; Sharma, Hemant K.; Pannell, Keith H.
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 13
• Pages of publication: 3136
• a: 6.8366 ± 0.0007 Å
• b: 13.386 ± 0.0015 Å
• c: 14.6784 ± 0.0016 Å
• α: 82.528 ± 0.002°
• β: 79.887 ± 0.002°
• γ: 81.766 ± 0.002°
• Cell volume: 1301.2 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0665
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1318
• Goodness-of-fit parameter for all reflections included in the refinement: 0.747
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No