Information card for entry 2210270

Structure parameters

• Chemical name: {2,4-Dichloro-6-[2- (dimethylamino)ethyliminomethyl]phenolato}thiocyanatonickel(II)
• Formula: C12 H13 Cl2 N3 Ni O S
• Calculated formula: C12 H13 Cl2 N3 Ni O S
• Title of publication: {2,4-Dichloro-6-[2-(dimethylamino)ethyliminomethyl]phenolato}thiocyanatonickel(II)
• Authors of publication: Yu-Liang Zhang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2111 - m2112
• a: 19.308 ± 0.001 Å
• b: 6.949 ± 0.002 Å
• c: 11.169 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1498.6 ± 0.5 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.0605
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0913
• Weighted residual factors for all reflections included in the refinement: 0.0989
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes