Information card for entry 2003470

Structure parameters

• Formula: C12 H19 Cu N5 O2 S
• Calculated formula: C12 H19 Cu N5 O2 S
• Title of publication: [3,9-Dimethyl-4,8-diaza-3,8-undecadiene-2,10-dione dioximato(1‒)](thiocyanato)copper(II) and [3,6,6,9-Tetramethyl-4,8-diaza-3,8-undecadiene-2,10-dione dioximato(1‒)](isothiocyanato)copper(II)
• Authors of publication: Tahirov, T. H.; Lu, T.-H.; Luh, H.; Lai, C.-Y.; Chung, C.-S.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 5
• Pages of publication: 846 - 849
• a: 7.275 ± 0.003 Å
• b: 7.711 ± 0.0007 Å
• c: 14.293 ± 0.001 Å
• α: 90.152 ± 0.007°
• β: 98.77 ± 0.01°
• γ: 100.49 ± 0.02°
• Cell volume: 778.8 ± 0.3 ų
• Cell temperature: 298 ± 3 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.099
• Goodness-of-fit parameter for significantly intense reflections: 2.37
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No