Information card for entry 7013481

Structure parameters

• Formula: C42 H80 Cl2 N4 Zn
• Calculated formula: C42 H80 Cl2 N4 Zn
• SMILES: [Zn](Cl)(Cl)([n]1cn(cc1)CCCCCCCCCCCCCCCCCC)[n]1cn(cc1)CCCCCCCCCCCCCCCCCC
• 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: 8.221 ± 0.003 Å
• b: 11.8579 ± 0.0012 Å
• c: 24.346 ± 0.003 Å
• α: 82.486 ± 0.007°
• β: 81.457 ± 0.012°
• γ: 84.442 ± 0.012°
• Cell volume: 2319.6 ± 0.9 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: 0.1709
• Residual factor for significantly intense reflections: 0.0749
• Weighted residual factors for significantly intense reflections: 0.184
• Weighted residual factors for all reflections included in the refinement: 0.2562
• Goodness-of-fit parameter for all reflections included in the refinement: 0.916
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No