Information card for entry 4067482

Structure parameters

• Formula: C7 H12 Cl2 Ge N2
• Calculated formula: C7 H12 Cl2 Ge N2
• SMILES: [Ge](Cl)(=C1N(C(=C(N1C)C)C)C)Cl
• Title of publication: On the Bonding in N-Heterocyclic Carbene Complexes of Germanium(II)
• Authors of publication: Ruddy, Adam J.; Rupar, Paul A.; Bladek, Kamila J.; Allan, Christopher J.; Avery, Jessica C.; Baines, Kim M.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 6
• Pages of publication: 1362
• a: 30.2766 ± 0.001 Å
• b: 7.5605 ± 0.0002 Å
• c: 9.3169 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2132.7 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0946
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1055
• Weighted residual factors for all reflections included in the refinement: 0.1242
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No