Information card for entry 7714376

Structure parameters

• Formula: C36 H31.5 Co F6 N5 O4.5 P
• Calculated formula: C36 H29.5 Co F6 N5 O3.5 P
• Title of publication: Polypyridyl-based Co(III) Complexes of Vitamin B6 Schiff base for Photoactivated Antibacterial Therapy
• Authors of publication: Mandal, Apurba; Rai, Rohit; Saha, Sukanta; Kushwaha, Rajesh; Li , Wei; Gogoi, Hemonta; Mandal, Arif Ali; Yadav, Ashish Kumar; Huang, Huaiyi; Dutta, Arnab; Dhar, Prodyut; Banerjee, Samya
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 21.4901 ± 0.0004 Å
• b: 15.8579 ± 0.0003 Å
• c: 21.6752 ± 0.0004 Å
• α: 90°
• β: 97.004 ± 0.002°
• γ: 90°
• Cell volume: 7331.5 ± 0.2 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0643
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.1383
• Weighted residual factors for all reflections included in the refinement: 0.1487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No