Information card for entry 4071247

Structure parameters

• Formula: C11 H12 Ge O3 W
• Calculated formula: C11 H12 Ge O3 W
• SMILES: [W]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: 6.822 ± 0.002 Å
• b: 13.361 ± 0.004 Å
• c: 14.685 ± 0.004 Å
• α: 82.509 ± 0.005°
• β: 79.76 ± 0.005°
• γ: 81.872 ± 0.005°
• Cell volume: 1296.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.051
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.1042
• Weighted residual factors for all reflections included in the refinement: 0.1082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No