Information card for entry 4503921

Structure parameters

• Common name: Compound 3 dcbcds
• Formula: C20 H26 Cd N6 O8 S
• Calculated formula: C20 H20 Cd N6 O8 S
• Title of publication: Six-Coordinated Cd(II) Centers as Four- or Six-Connected Nodes in Coordination Polymer Networks Containing Bis(4-pyridyl)amine
• Authors of publication: Cordes, David B.; Hanton, Lyall R.; Spicer, Mark D.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2007
• Journal volume: 7
• Journal issue: 2
• Pages of publication: 328
• a: 17.268 ± 0.005 Å
• b: 15.465 ± 0.005 Å
• c: 17.929 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4788 ± 2 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0589
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0718
• Weighted residual factors for all reflections included in the refinement: 0.0835
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No