Information card for entry 7211091

Structure parameters

• Formula: C96 H83 Mn5 N8 O22 P2
• Calculated formula: C96 H83 Mn5 N8 O22 P2
• Title of publication: Four coordination clusters using fluorenyl and carbazyl phosphonates as ligands
• Authors of publication: Ma, Yun-Sheng; Cai, Wang-Shui; Chen, Bin; Chang, Jian-Yu; Tang, Xiao-Yan; Yuan, Rong-Xin
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 37
• Pages of publication: 7615
• a: 16.7089 ± 0.0013 Å
• b: 33.4493 ± 0.0017 Å
• c: 18.7258 ± 0.0011 Å
• α: 90°
• β: 97.315 ± 0.003°
• γ: 90°
• Cell volume: 10380.7 ± 1.1 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0862
• Residual factor for significantly intense reflections: 0.0614
• Weighted residual factors for significantly intense reflections: 0.1429
• Weighted residual factors for all reflections included in the refinement: 0.1502
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No