Information card for entry 7243167

Structure parameters

• Chemical name: Di-u-methoxy-bis[chlorido(dimethylsulfoxide-κO) (1,3,5-triazine-2,4,6-triamine-κN1)copper(II)(Cu-Cu)]
• Formula: C6 H15 Cl Cu N6 O2 S
• Calculated formula: C6 H15 Cl Cu N6 O2 S
• Title of publication: Crystal engineering with copper and melamine
• Authors of publication: Bernabé Vírseda, Ignacio; Siddiqui, Shiraz Ahmed; Prado-Roller, Alexander; Eisterer, Michael; Shiozawa, Hidetsugu
• Journal of publication: RSC Advances
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 39
• Pages of publication: 23943 - 23947
• a: 10.4677 ± 0.0014 Å
• b: 11.58 ± 0.002 Å
• c: 14.375 ± 0.003 Å
• α: 106.116 ± 0.008°
• β: 99.25 ± 0.008°
• γ: 102.092 ± 0.008°
• Cell volume: 1591.8 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0617
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1299
• Weighted residual factors for all reflections included in the refinement: 0.1353
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No