Information card for entry 7250345

Structure parameters

• Formula: C42 H27 Br2 Co F12 N6 P2
• Calculated formula: C42 H27 Br2 Co F12 N6 P2
• Title of publication: A cobalt(ii)-terpyridine complex showing field-induced slow magnetic relaxation behavior via reverse spin-crossover
• Authors of publication: Huang, Long; Zhang, Kun-Hua; Sun, Ao-Na; Zhao, Bingshan; Shi, Le; Yang, Jiong; Shao, Dong
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 21
• Pages of publication: 3545 - 3551
• a: 8.9399 ± 0.0008 Å
• b: 10.9873 ± 0.0009 Å
• c: 22.232 ± 0.0017 Å
• α: 85.466 ± 0.003°
• β: 79.88 ± 0.004°
• γ: 72.11 ± 0.004°
• Cell volume: 2045.1 ± 0.3 ų
• Cell temperature: 119.95 K
• Ambient diffraction temperature: 119.95 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: 0.1225
• Residual factor for significantly intense reflections: 0.0551
• Weighted residual factors for significantly intense reflections: 0.1033
• Weighted residual factors for all reflections included in the refinement: 0.1317
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No