Information card for entry 2207176

Structure parameters

• Chemical name: {2,4-Dichloro-6-[2- (dimethylamino)ethyliminomethyl]phenolato}thiocyanatocopper(II)
• Formula: C12 H13 Cl2 Cu N3 O S
• Calculated formula: C12 H13 Cl2 Cu N3 O S
• Title of publication: {2,4-Dichloro-6-[2-(dimethylamino)ethyliminomethyl]phenolato}thiocyanatocopper(II)
• Authors of publication: You, Zhong-Lu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: m2226 - m2227
• a: 19.301 ± 0.002 Å
• b: 6.95 ± 0.001 Å
• c: 11.173 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1498.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0695
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.1048
• Weighted residual factors for all reflections included in the refinement: 0.1149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No