Information card for entry 2235813

Structure parameters

• Chemical name: Bis[3,3'-(piperazine-1,4-diyl)dipropanaminium] di-μ~2~-sulfido-bis[disulfidogermanate(IV)]
• Formula: C20 H52 Ge2 N8 S6
• Calculated formula: C20 H52 Ge2 N8 S6
• SMILES: C1CN(CCN1CCC[NH3+])CCC[NH3+].S1[Ge]([S-])([S-])S[Ge]1([S-])[S-].C1CN(CCN1CCC[NH3+])CCC[NH3+]
• Title of publication: Bis[3,3'-(piperazine-1,4-diyl)dipropanaminium] di-μ~2~-sulfido-bis[disulfidogermanate(IV)]
• Authors of publication: Wang, Nian-Nian; 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: 8
• Pages of publication: m1046
• a: 12.0111 ± 0.0004 Å
• b: 7.7759 ± 0.0003 Å
• c: 18.9777 ± 0.0007 Å
• α: 90°
• β: 103.569 ± 0.001°
• γ: 90°
• Cell volume: 1722.99 ± 0.11 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0506
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.1064
• Weighted residual factors for all reflections included in the refinement: 0.113
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes