Information card for entry 2202751

Structure parameters

• Chemical name: 2,2-Dimethoxy-1,3,2-dithiagermole-4,5-dicarbonitrile
• Formula: C6 H4 Ge N2 O2 S2
• Calculated formula: C6 H4 Ge N2 O2 S2
• Title of publication: 2,2-Dimethoxy-1,3,2-dithiagermole-4,5-dicarbonitrile
• Authors of publication: Sema Öztürk; Mehmet Akkurt; Tevfik Rıza Kök; Hoong-Kun Fun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: m1018 - m1019
• a: 12.296 ± 0.0008 Å
• b: 9.7463 ± 0.0007 Å
• c: 9.9583 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1193.41 ± 0.14 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 58
• Hermann-Mauguin space group symbol: P n n m
• Hall space group symbol: -P 2 2n
• Residual factor for all reflections: 0.0457
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.1012
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No