Information card for entry 2235162

Structure parameters

• Chemical name: Bis[4-(2-azaniumylethyl)piperazin-1-ium] di-μ-sulfido-bis[disulfidogermanate(II)]
• Formula: C12 H34 Ge2 N6 S6
• Calculated formula: C12 H34 Ge2 N6 S6
• SMILES: C1CN(CC[NH2+]1)CC[NH3+].[S-][Ge]1(S[Ge](S1)([S-])[S-])[S-].C1CN(CC[NH2+]1)CC[NH3+]
• Title of publication: Bis[4-(2-azaniumylethyl)piperazin-1-ium] di-μ-sulfido-bis[disulfidogermanate(II)]
• Authors of publication: Zhang, Bei-Bei; Xu, Chao; Duan, Taike; Chen, Qun; Zhang, Qian-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 6
• Pages of publication: m822
• a: 7.4985 ± 0.0001 Å
• b: 8.2709 ± 0.0001 Å
• c: 10.4177 ± 0.0001 Å
• α: 72.156 ± 0.001°
• β: 78.323 ± 0.001°
• γ: 89.792 ± 0.001°
• Cell volume: 601.107 ± 0.013 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0192
• Residual factor for significantly intense reflections: 0.0172
• Weighted residual factors for significantly intense reflections: 0.0429
• Weighted residual factors for all reflections included in the refinement: 0.0437
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes