Information card for entry 4075549

Structure parameters

• Common name: 2-napthyl-Co(dmgH)2Py
• Chemical name: 2-Napthyl-bis(dimethylglyoximeto)(pyridine)cobalt(III)
• Formula: C24 H28 Co N5 O4
• Calculated formula: C24 H28 Co N5 O4
• SMILES: [Co]12([N](O)=C(C(=N1=O)C)C)([N](O)=C(C(=N2=O)C)C)([n]1ccccc1)Cc1ccc2c(c1)cccc2
• Title of publication: Hindered Rotation Leading to Nonequivalence in Cobaloximes
• Authors of publication: Mandal, Debaprasad; Gupta, B. D.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 14
• Pages of publication: 3305
• a: 10.0739 ± 0.0014 Å
• b: 11.3738 ± 0.0016 Å
• c: 12.1513 ± 0.0017 Å
• α: 110.607 ± 0.002°
• β: 100.011 ± 0.002°
• γ: 109.289 ± 0.002°
• Cell volume: 1161.8 ± 0.3 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: 0.1147
• Residual factor for significantly intense reflections: 0.0897
• Weighted residual factors for significantly intense reflections: 0.2085
• Weighted residual factors for all reflections included in the refinement: 0.2241
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No