Information card for entry 4060113

Structure parameters

• Formula: C45 H80 Ge Se Si6
• Calculated formula: C45 H80 Ge Se Si6
• Title of publication: Reactions of a Germacyclopropabenzene with Elemental Chalcogens: Syntheses and Structures of a Series of Stable 2H-Benzo[c][1,2]chalcogenagermetes
• Authors of publication: Sasamori, Takahiro; Sasaki, Takayo; Takeda, Nobuhiro; Tokitoh, Norihiro
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 4
• Pages of publication: 612 - 618
• a: 11.874 ± 0.004 Å
• b: 12.5 ± 0.005 Å
• c: 19.77 ± 0.006 Å
• α: 77.426 ± 0.017°
• β: 88.937 ± 0.016°
• γ: 65.979 ± 0.005°
• Cell volume: 2607.8 ± 1.6 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 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: 0.1528
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for significantly intense reflections: 0.1294
• Weighted residual factors for all reflections included in the refinement: 0.1502
• Goodness-of-fit parameter for all reflections included in the refinement: 0.93
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No