Information card for entry 2013367

Structure parameters

• Formula: C19 H30 Co N5 O4
• Calculated formula: C19 H30 Co N5 O4
• SMILES: [Co]12(N([O])C(=C(N1[O])C)C)(N(O)C(=C(N2O)C)C)([n]1ccccc1)C(=C)CCCC
• Title of publication: <i>trans</i>-Bis(dimethylglyoximato-κ^2^<i>N</i>,<i>N</i>')(1-hexenyl)(pyridine-κ<i>N</i>)cobalt(III): a cobaloxime-substituted terminal alkene that rapidly isomerizes to a cobaloxime-substituted internal alkenyl complex
• Authors of publication: Pickin, Kerry A.; Day, Cynthia S.; Wright, Marcus W.; Welker, Mark E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 5
• Pages of publication: m193 - m195
• a: 8.268 ± 0.003 Å
• b: 11.757 ± 0.003 Å
• c: 11.0253 ± 0.0019 Å
• α: 90°
• β: 93.721 ± 0.018°
• γ: 90°
• Cell volume: 1069.5 ± 0.5 ų
• Cell temperature: 228 ± 2 K
• Ambient diffraction temperature: 228 ± 2 K
• Number of distinct elements: 5
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0502
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.1007
• Weighted residual factors for all reflections included in the refinement: 0.1058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes