Information card for entry 4339445

Structure parameters

• Formula: C52 H56 Cu2 F8 Mo8 N24 O34
• Calculated formula: C52 H56 Cu2 F8 Mo8 N24 O34
• Title of publication: Syntheses and structures of organic-inorganic hybrid compounds based on metal-fluconazole coordination polymers and the beta-Mo8O26 anion.
• Authors of publication: Li, Shun-Li; Lan, Ya-Qian; Ma, Jian-Fang; Yang, Jin; Wang, Xiao-Hong; Su, Zhong-Min
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 20
• Pages of publication: 8283 - 8290
• a: 12.042 ± 0.0009 Å
• b: 12.174 ± 0.0009 Å
• c: 15.041 ± 0.0012 Å
• α: 100.456 ± 0.001°
• β: 94.465 ± 0.001°
• γ: 111.19 ± 0.001°
• Cell volume: 1996.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0526
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0995
• Weighted residual factors for all reflections included in the refinement: 0.1069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No