Information card for entry 7114774

Structure parameters

• Common name: (CuI)bpds.CH2CL2
• Chemical name: copperiodide bipyridyldisulfide dichloromethane solvate
• Formula: C11 H10 Cl2 Cu I N2 S2
• Calculated formula: C11 H10 Cl2 Cu I N2 S2
• Title of publication: Topological isomerism in coordination polymers
• Authors of publication: Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Crew, Marcello; Gregory, Duncan H.; Hubberstey, Peter; Schröder, Martin; Deveson, Anne; Fenske, Dieter; Hanton, Lyall R.
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 16
• Pages of publication: 1432
• a: 8.425 ± 0.0017 Å
• b: 10.318 ± 0.002 Å
• c: 10.67 ± 0.002 Å
• α: 113.92 ± 0.03°
• β: 97.23 ± 0.03°
• γ: 92.21 ± 0.03°
• Cell volume: 837 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 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: 0.0555
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1483
• Weighted residual factors for all reflections included in the refinement: 0.1496
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No