Information card for entry 1546719

Structure parameters

• Chemical name: Bis(4,6-di-<i>tert</i>-butyl-2-{<i>N</i>-[4-(diethylamino)phenyl]carboximidoyl}phenolato)cobalt(II)
• Formula: C50 H70 Co N4 O2
• Calculated formula: C50 H70 Co N4 O2
• SMILES: [Co]12(Oc3c(cc(cc3C=[N]1c1ccc(N(CC)CC)cc1)C(C)(C)C)C(C)(C)C)Oc1c(cc(cc1C=[N]2c1ccc(N(CC)CC)cc1)C(C)(C)C)C(C)(C)C
• Title of publication: Bis(4,6-di-tert-butyl-2-{N-[4-(diethylamino)phenyl]carboximidoyl}phenolato)cobalt(II)
• Authors of publication: Rani, C.Vidya; Mitu, L.; Chakkaravarthi, G.; Rajagopal, G.
• Journal of publication: IUCrData
• Year of publication: 2017
• Journal volume: 2
• Journal issue: 6
• a: 11.946 ± 0.0001 Å
• b: 13.218 ± 0.0002 Å
• c: 17.434 ± 0.0002 Å
• α: 109.348 ± 0.001°
• β: 96.35 ± 0.001°
• γ: 98.881 ± 0.002°
• Cell volume: 2527.33 ± 0.06 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0692
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1375
• Weighted residual factors for all reflections included in the refinement: 0.1464
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes