Information card for entry 2225681

Structure parameters

• Chemical name: (2<i>R</i>)-2-Methylpiperazinediium tetrachloridocuprate(II)
• Formula: C5 H14 Cl4 Cu N2
• Calculated formula: C5 H14 Cl4 Cu N2
• SMILES: [Cu](Cl)(Cl)([Cl-])[Cl-].[NH2+]1CC[NH2+][C@H](C)C1
• Title of publication: (2<i>R</i>)-2-Methylpiperazinediium tetrachloridocuprate(II)
• Authors of publication: Chen, Li Zhaung; Wan, Sheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: m376
• a: 6.0169 ± 0.0012 Å
• b: 12.985 ± 0.003 Å
• c: 14.644 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1144.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0272
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0591
• Weighted residual factors for all reflections included in the refinement: 0.0601
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes