Information card for entry 4508497

Structure parameters

• Formula: C42 H28 N3 O6 S Zn
• Calculated formula: C42 H28 N3 O6 S Zn
• Title of publication: Three 2D/2D →2D or 3D Coordination Polymers: Parallel Stacked, Interpenetration, and Polycatenated
• Authors of publication: Qin, Ling; Zhang, Mingdao; Yang, Qingxiang; Li, Yizhi; Zheng, Hegen
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 11
• Pages of publication: 5045
• a: 11.4023 ± 0.001 Å
• b: 13.7749 ± 0.0013 Å
• c: 15.7837 ± 0.0014 Å
• α: 105.578 ± 0.002°
• β: 105.825 ± 0.002°
• γ: 92.342 ± 0.002°
• Cell volume: 2280 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0682
• Residual factor for significantly intense reflections: 0.0542
• Weighted residual factors for significantly intense reflections: 0.1436
• Weighted residual factors for all reflections included in the refinement: 0.1495
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No