Information card for entry 7039162

Structure parameters

• Common name: Co(Tp*)2
• Chemical name: Cobalt Bis-hydridotris(3,5-dimethylpyrazole)borate
• Formula: C30 H44 B2 Co N12
• Calculated formula: C30 H44 B2 Co N12
• SMILES: [BH]12n3c(C)cc(C)[n]3[Co]34([n]5n1c(C)cc5C)([n]1c(cc(C)n21)C)[n]1c(cc(C)n1[BH](n1[n]3c(cc1C)C)n1c(C)cc([n]41)C)C
• Title of publication: Two field-induced slow magnetic relaxation processes in a mononuclear Co(ii) complex with a distorted octahedral geometry.
• Authors of publication: Li, Jing; Han, Yuan; Cao, Fan; Wei, Rong-Min; Zhang, Yi-Quan; Song, You
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 22
• Pages of publication: 9279 - 9284
• a: 8.8252 ± 0.0014 Å
• b: 10.8259 ± 0.0017 Å
• c: 11.028 ± 0.003 Å
• α: 106.446 ± 0.003°
• β: 108.868 ± 0.003°
• γ: 109.701 ± 0.002°
• Cell volume: 842.8 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0489
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.1167
• Weighted residual factors for all reflections included in the refinement: 0.1258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No