Information card for entry 7053648

Structure parameters

• Common name: 4
• Formula: C19 H28 Cd I2 N4 O2 S2
• Calculated formula: C19 H28 Cd I2 N4 O2 S2
• Title of publication: Solvent-mediated conformational similarities within a series of 1D coordination polymers constructed from a new flexible ditopic bis-imidazole ligand
• Authors of publication: Potts, Storm V.; Barbour, Leonard J.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2010
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 2451
• a: 32.585 ± 0.004 Å
• b: 10.2983 ± 0.0014 Å
• c: 19.944 ± 0.003 Å
• α: 90°
• β: 125.829 ± 0.002°
• γ: 90°
• Cell volume: 5426.2 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0803
• Residual factor for significantly intense reflections: 0.0567
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1166
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No