Information card for entry 2015992

Structure parameters

• Chemical name: <i>trans</i>-Dichloridotetrakis(3,5-dimethylpyridine)copper(II)
• Formula: C28 H36 Cl2 Cu N4
• Calculated formula: C28 H36 Cl2 Cu N4
• SMILES: c1c(cc(c[n]1[Cu](Cl)([n]1cc(cc(c1)C)C)([n]1cc(cc(c1)C)C)([n]1cc(cc(c1)C)C)Cl)C)C
• Title of publication: <i>trans</i>-Dichloridotetrakis(3,5-dimethylpyridine)copper(II)
• Authors of publication: Martone, Daniel P.; Maverick, Andrew W.; Fronczek, Frank R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m238 - m239
• a: 11.3324 ± 0.0015 Å
• b: 11.3324 ± 0.0015 Å
• c: 10.894 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1399 ± 0.4 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 5
• Space group number: 126
• Hermann-Mauguin space group symbol: P 4/n n c :2
• Hall space group symbol: -P 4a 2bc
• Residual factor for all reflections: 0.044
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes