Information card for entry 7019020

Structure parameters

• Formula: C36 H54 F12 N4 O P2 S4 Zn
• Calculated formula: C36 H54 F12 N4 O P2 S4 Zn
• Title of publication: Group 12 metal zwitterionic thiolate compounds: preparation and structural characterization.
• Authors of publication: Tang, Xiao-Yan; Yuan, Rong-Xin; Chen, Jin-Xiang; Zhao, Wei; Zheng, Ai-Xia; Yu, Miao; Li, Hong-Xi; Ren, Zhi-Gang; Lang, Jian-Ping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 20
• Pages of publication: 6162 - 6172
• a: 13.866 ± 0.003 Å
• b: 35.254 ± 0.003 Å
• c: 10.231 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5001.2 ± 1.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 8
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0589
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1086
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No