Information card for entry 4078602

Structure parameters

• Formula: C20 H17 Ge N
• Calculated formula: C20 H17 Ge N
• SMILES: C(#N)C[Ge](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthetic, Structural, and Physical Investigations of the Large Linear and Branched Oligogermanes Ph3GeGePh2GePh2GePh2H, Ge5Ph12, and (Ph3Ge)4Ge
• Authors of publication: Samanamu, Christian R.; Amadoruge, Monika L.; Schrick, Aaron C.; Chen, Chao; Golen, James A.; Rheingold, Arnold L.; Materer, Nicholas F.; Weinert, Charles S.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 11
• Pages of publication: 4374
• a: 9.4123 ± 0.0019 Å
• b: 9.4402 ± 0.0019 Å
• c: 9.779 ± 0.002 Å
• α: 92.021 ± 0.003°
• β: 108.696 ± 0.003°
• γ: 98.341 ± 0.003°
• Cell volume: 811.2 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0831
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1102
• Weighted residual factors for all reflections included in the refinement: 0.1249
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No