Information card for entry 4326180

Structure parameters

• Formula: C36 H25 B Cl Cr Mn N13 O4
• Calculated formula: C36 H26 B Cl Cr Mn N13 O4
• Title of publication: Syntheses, Structures, and Magnetic Properties of Low-Dimensional Heterometallic Complexes Based on the Versatile Building Block [(Tp)Cr(CN)3]-
• Authors of publication: Min-Xia Yao; Zheng-You Wei; Zhi-Guo Gu; Qi Zheng; Yan Xu; Jing-Lin Zuo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 8636 - 8644
• a: 12.9684 ± 0.001 Å
• b: 12.9945 ± 0.0011 Å
• c: 13.6671 ± 0.0011 Å
• α: 65.832 ± 0.001°
• β: 70.482 ± 0.001°
• γ: 67.183 ± 0.001°
• Cell volume: 1894.3 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1127
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.0765
• Goodness-of-fit parameter for all reflections included in the refinement: 0.91
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No