Information card for entry 2233842

Structure parameters

• Chemical name: Bis(diisopropylammonium) tetrachloridocuprate(II)
• Formula: C12 H32 Cl4 Cu N2
• Calculated formula: C12 H32 Cl4 Cu N2
• SMILES: [NH2+](C(C)C)C(C)C.[NH2+](C(C)C)C(C)C.[Cu](Cl)(Cl)([Cl-])[Cl-]
• Title of publication: Bis(diisopropylammonium) tetrachloridocuprate(II)
• Authors of publication: Xu, Jie
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: m285
• a: 10.541 ± 0.002 Å
• b: 14.402 ± 0.003 Å
• c: 14.641 ± 0.006 Å
• α: 90°
• β: 114.38 ± 0.02°
• γ: 90°
• Cell volume: 2024.5 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0447
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0774
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes