Information card for entry 4073081

Structure parameters

• Formula: C31 H40 Ge2 Mo N4 O4
• Calculated formula: C31 H40 Ge2 Mo N4 O4
• SMILES: [Ge]12N(c3c(N2CC(C)(C)C)cccc3)CC(C)(C)CN2[Ge](N(c3c2cccc3)CC(C)(C)C)=[Mo]=1(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Preparation and Coordination Chemistry of Bidentate Benzimidazoline-2-germylenes
• Authors of publication: Zabula, Alexander V.; Hahn, F. Ekkehardt; Pape, Tania; Hepp, Alexander
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 8
• Pages of publication: 1972
• a: 10.4872 ± 0.0013 Å
• b: 12.4823 ± 0.0016 Å
• c: 13.8925 ± 0.0017 Å
• α: 102.47 ± 0.003°
• β: 108.32 ± 0.003°
• γ: 98.591 ± 0.003°
• Cell volume: 1638.7 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.0706
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.0954
• Weighted residual factors for all reflections included in the refinement: 0.1026
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No