Information card for entry 4302369

Structure parameters

• Formula: C60 H44 As2 Mn2 N10 O2 S5
• Calculated formula: C60 H44 As2 Mn2 N10 O2 S5
• Title of publication: Hydrothermal Syntheses and Characterizations of Thioarsenates [Fe(phen)~3~][As~3~S~6~]·dien·7H~2~O and [Mn~2~(phen)~4~(As~2~S~5~)]·phen·2H~2~O: A New Coordination Mode of the As~2~S~5~^4-^ Anion
• Authors of publication: Pan, Yingli; Jin, Qinyan; Chen, Jiangfang; Zhang, Yong; Jia, Dingxian
• Journal of publication: Inorganic chemistry
• Year of publication: 2009
• Journal volume: 48
• Journal issue: 12
• Pages of publication: 5412 - 5417
• a: 12.959 ± 0.002 Å
• b: 20.696 ± 0.003 Å
• c: 21.97 ± 0.004 Å
• α: 90°
• β: 99.173 ± 0.006°
• γ: 90°
• Cell volume: 5817 ± 1.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1007
• Residual factor for significantly intense reflections: 0.0765
• Weighted residual factors for significantly intense reflections: 0.1568
• Weighted residual factors for all reflections included in the refinement: 0.1669
• Goodness-of-fit parameter for all reflections included in the refinement: 1.131
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 4338565
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No