Information card for entry 4508597

Structure parameters

• Formula: C36 H38 N10 Ni O8 S2
• Calculated formula: C36 H38 N10 Ni O8 S2
• Title of publication: Comprehensive Study on Mutual Interplay of Multiple V-Shaped Ligands on the Helical Nature of a Series of Coordination Polymers and Their Properties
• Authors of publication: Goswami, Arijit; Bala, Sukhen; Pachfule, Pradip; Mondal, Raju
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 12
• Pages of publication: 5487
• a: 13.739 ± 0.006 Å
• b: 15.73 ± 0.007 Å
• c: 18.234 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3941 ± 3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1306
• Residual factor for significantly intense reflections: 0.0602
• Weighted residual factors for significantly intense reflections: 0.1274
• Weighted residual factors for all reflections included in the refinement: 0.1552
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No