Information card for entry 7055150

Structure parameters

• Formula: C126 H108 B2 Fe2 Mn2 N26 O2
• Calculated formula: C124.428 H101.284 B2 Fe2 Mn2 N26 O2
• Title of publication: Cyanide-bridged heterobimetallic magnetic complexes based on metalloporphyrinate and tricyanometalate building blocks
• Authors of publication: Gao, Feng; Zhu, Guang-Zhou; Yang, Liu; Yao, Min-Xia
• Journal of publication: New J. Chem.
• Year of publication: 2016
• Journal volume: 40
• Journal issue: 1
• Pages of publication: 365
• a: 13.471 ± 0.003 Å
• b: 14.06 ± 0.003 Å
• c: 18.498 ± 0.004 Å
• α: 106.035 ± 0.003°
• β: 103.8 ± 0.003°
• γ: 92.507 ± 0.003°
• Cell volume: 3247.4 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0727
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for significantly intense reflections: 0.1879
• Weighted residual factors for all reflections included in the refinement: 0.2004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No