Information card for entry 7013480

Structure parameters

• Formula: C30 H56 Cl2 Cu N4
• Calculated formula: C30 H56 Cl2 Cu N4
• SMILES: [Cu](Cl)(Cl)([n]1cn(cc1)CCCCCCCCCCCC)[n]1cn(cc1)CCCCCCCCCCCC
• Title of publication: Organic–inorganic hybrids of imidazole complexes of palladium(II), copper(II) and zinc(II). Crystals and liquid crystals
• Authors of publication: Lee, Ching Kuan; Ling, Mei Jing; Lin, Ivan J. B.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 24
• Pages of publication: 4731 - 4737
• a: 8.3007 ± 0.001 Å
• b: 10.732 ± 0.002 Å
• c: 19.3765 ± 0.0018 Å
• α: 77.929 ± 0.01°
• β: 89.33 ± 0.008°
• γ: 87.332 ± 0.016°
• Cell volume: 1686.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0499
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0983
• Weighted residual factors for all reflections included in the refinement: 0.1052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No