Information card for entry 7250916

Structure parameters

• Formula: C56 H37 B2 Co F8 N7
• Calculated formula: C56 H37 B2 Co F8 N7
• Title of publication: Observation of spin-crossover behaviour in Co(ii)-terpyridine complexes possessing π-conjugated substations
• Authors of publication: Soejima, Keita; Sekine, Yoshihiro; Miyake, Kanta; Kiba, Kota; Yamaguchi, Yuito; Zenno, Hikaru; Hayami, Shinya
• Journal of publication: RSC Advances
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 43
• Pages of publication: 35892 - 35898
• a: 14.6941 ± 0.0004 Å
• b: 16.9594 ± 0.0004 Å
• c: 19.7961 ± 0.0005 Å
• α: 90°
• β: 104.323 ± 0.003°
• γ: 90°
• Cell volume: 4779.9 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0706
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1023
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No