Information card for entry 4313153

Structure parameters

• Formula: C18 H16 N8 S2 Zn
• Calculated formula: C18 H16 N8 S2 Zn
• Title of publication: Novel Pb and Zn Coordination Polymers: Synthesis, Molecular Structures, and Third-Order Nonlinear Optical Properties
• Authors of publication: Xiangru Meng; Yinglin Song; Hongwei Hou; Yaoting Fan; Gang Li; Yu Zhu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 1306 - 1315
• a: 10.218 ± 0.002 Å
• b: 13.251 ± 0.003 Å
• c: 8.21 ± 0.002 Å
• α: 98.42 ± 0.03°
• β: 106.65 ± 0.03°
• γ: 90.3 ± 0.03°
• Cell volume: 1052.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0888
• Residual factor for significantly intense reflections: 0.0647
• Weighted residual factors for all reflections: 0.1587
• Weighted residual factors for significantly intense reflections: 0.1464
• Goodness-of-fit parameter for all reflections: 1.055
• Goodness-of-fit parameter for significantly intense reflections: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No