Information card for entry 4309093

Structure parameters

• Formula: C72 H53 B Mn2 N17 O0.5
• Calculated formula: C72 H52 B Mn2 N17 O0.5
• Title of publication: Assembly of Azido- or Cyano-Bridged Binuclear Complexes Containing the Bulky [Mn(phen)2]2+ Building Block: Syntheses, Crystal Structures, and Magnetic Properties
• Authors of publication: Zhong-Hai Ni; Hui-Zhong Kou; Lei Zheng; Yi-Hua Zhao; Li-Fang Zhang; Ru-Ji Wang; Ai-Li Cui; Osamu Sato
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 4728 - 4736
• a: 13.378 ± 0.003 Å
• b: 13.406 ± 0.003 Å
• c: 18.851 ± 0.004 Å
• α: 88.99 ± 0.03°
• β: 72.64 ± 0.03°
• γ: 81.04 ± 0.03°
• Cell volume: 3186 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1835
• Residual factor for significantly intense reflections: 0.094
• Weighted residual factors for significantly intense reflections: 0.1478
• Weighted residual factors for all reflections included in the refinement: 0.1688
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No