Information card for entry 7249672

Structure parameters

• Formula: C29 H31 B2 Co F4 Fe N16 O2
• Calculated formula: C29 H31 B2 Co F4 Fe N16 O2
• Title of publication: Structural regulation of three Fe–Co cyanometallate complexes: reactant ratio issue
• Authors of publication: Li, Qiuyu; Cao, Qiuyue; Xi, Jing; Zhang, Ziyi; Yao, Binling; Shao, Dong; Deng, Yi-Fei; Zhang, Yuan-Zhu
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 3
• Pages of publication: 407 - 414
• a: 12.1471 ± 0.0008 Å
• b: 26.0291 ± 0.0014 Å
• c: 12.147 ± 0.0008 Å
• α: 90°
• β: 106.52°
• γ: 90°
• Cell volume: 3682.1 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1083
• Residual factor for significantly intense reflections: 0.0826
• Weighted residual factors for significantly intense reflections: 0.2033
• Weighted residual factors for all reflections included in the refinement: 0.2145
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No