Information card for entry 4075997

Structure parameters

• Common name: m-xylylene-dicobaloxime
• Chemical name: 2-nitro meta-xylylene benzyl pyridine dimethylglyoximato dicobaloxime
• Formula: C36 H51 Co2 N11 O11
• Calculated formula: C36 H51 Co2 N11 O11
• SMILES: [Co]12([N](O)=C(C(=N1=O)C)C)([N](O)=C(C(=N2=O)C)C)([n]1ccccc1)Cc1cccc(c1N(=O)=O)C[Co]12(N(=O)=C(C(=N1=O)C)C)([N](O)=C(C(=[N]2O)C)C)[n]1ccccc1.C(C)O
• Title of publication: 2-Substitutedm-Xylylene-Bridged Dicobaloximes: Structure−Property Relationship Using Variable-Temperature1H NMR Study†
• Authors of publication: Vijaikanth, V.; Gupta, B. D.; Mandal, Debaprasad; Shekhar, Shashank
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 18
• Pages of publication: 4454
• a: 8.495 ± 0.007 Å
• b: 15.544 ± 0.012 Å
• c: 16.264 ± 0.012 Å
• α: 73.74 ± 0.01°
• β: 85.911 ± 0.002°
• γ: 77.53 ± 0.01°
• Cell volume: 2013 ± 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: 0.0894
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1584
• Weighted residual factors for all reflections included in the refinement: 0.1705
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No