Information card for entry 4350783

Structure parameters

• Chemical name: bis(acetonitrile)-diaqua-bis[6-(pyridin-4-yl)-1,3,5-triazine-2,4-diamine] -cobalt diperchlorate acetonitrile solvate
• Formula: C24 H32 Cl2 Co N16 O10
• Calculated formula: C24 H32 Cl2 Co N16 O10
• Title of publication: Amidine/Amidinate Cobalt Complexes: One-Pot Synthesis, Mechanism, and Photocatalytic Application for Hydrogen Production
• Authors of publication: Rajak, Sanil; Chair,Khaoula; Rana, Love Karan; Kaur, Prabhjyot; Maris, Thierry; Duong, Adam
• Journal of publication: Inorganic Chemistry
• Year of publication: 2020
• Journal volume: 59
• Pages of publication: 14910 - 14919
• a: 11.5878 ± 0.0006 Å
• b: 7.4968 ± 0.0004 Å
• c: 21.0318 ± 0.0011 Å
• α: 90°
• β: 100.942 ± 0.003°
• γ: 90°
• Cell volume: 1793.85 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0789
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.0945
• Weighted residual factors for all reflections included in the refinement: 0.1016
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes