Information card for entry 4505903

Structure parameters

• Chemical name: tris(2,2'-bipyridine-4,4'-diamine)cadmium(II) chloride hydrate
• Formula: C30 H35.5 Cd Cl2 N12 O2.75
• Calculated formula: C30 H30 Cd Cl2 N12 O2.75
• Title of publication: Metal Complexes of 2,2′-Bipyridine-4,4′-diamine as Metallo-Tectons for Hydrogen Bonded Networks
• Authors of publication: Rigby, Nicola; Jacobs, Tia; Reddy, Jayarama Prakasha; Hardie, Michaele J.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 4
• Pages of publication: 1871
• a: 31.7204 ± 0.001 Å
• b: 31.7204 ± 0.001 Å
• c: 13.7906 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13875.9 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0742
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.1372
• Weighted residual factors for all reflections included in the refinement: 0.1546
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No