Information card for entry 4343426

Structure parameters

• Formula: C33 H35 Co N4 O2
• Calculated formula: C33 H35 Co N4 O2
• SMILES: [Co]12(Oc3c(O1)c(ccc3C(C)(C)C)C(C)(C)C)N(N=C(N=[N]2c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: Heteroligand o-Semiquinonato-Formazanato Cobalt Complexes.
• Authors of publication: Protasenko, Natalia A.; Poddel'sky, Andrey I.; Bogomyakov, Artem S.; Fukin, Georgy K.; Cherkasov, Vladimir K.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 13
• Pages of publication: 6078 - 6080
• a: 9.609 ± 0.0009 Å
• b: 10.7936 ± 0.0011 Å
• c: 14.8816 ± 0.0015 Å
• α: 99.022 ± 0.002°
• β: 103.509 ± 0.002°
• γ: 103.094 ± 0.002°
• Cell volume: 1425.4 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0443
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0881
• Weighted residual factors for all reflections included in the refinement: 0.0912
• 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