Information card for entry 7035212

Structure parameters

• Chemical name: iPrGe5
• Formula: C40 H70 Ge5
• Calculated formula: C40 H70 Ge5
• SMILES: [Ge]1(C#C[Ge](C#C[Ge](C#C[Ge](C#C[Ge](C#C1)(C(C)C)C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C
• Title of publication: Stepwise synthesis and characterization of germa[4], [5], [8], and [10]pericyclynes.
• Authors of publication: Tanimoto, Hiroki; Nagao, Tomohiko; Fujiwara, Taro; Nishiyama, Yasuhiro; Morimoto, Tsumoru; Suzuka, Toshimasa; Tsutsumi, Ken; Kakiuchi, Kiyomi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 26
• Pages of publication: 11811 - 11818
• a: 11.289 ± 0.0002 Å
• b: 49.9471 ± 0.0009 Å
• c: 16.5855 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9351.8 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 3
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0734
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for significantly intense reflections: 0.0942
• Weighted residual factors for all reflections included in the refinement: 0.0971
• Goodness-of-fit parameter for all reflections included in the refinement: 1.128
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No