Information card for entry 7014702

Structure parameters

• Formula: C30 H18 Co N6 O4
• Calculated formula: C30 H18 Co N6 O4
• SMILES: [Co]123([n]4c(cccc4)C(=O)O1)([n]1c(cccc1)C(=O)O2)[n]1c2c4[n]3cccc4c3nc4ccccc4nc3c2ccc1
• Title of publication: Mixed ligand cobalt(II) picolinate complexes: synthesis, characterization, DNA binding and photocleavage.
• Authors of publication: Kawade, Vitthal A.; Kumbhar, Anupa A.; Kumbhar, Avinash S.; Näther, Christian; Erxleben, Andrea; Sonawane, Uddhavesh B.; Joshi, Rajendra R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 3
• Pages of publication: 639 - 650
• a: 24.0172 ± 0.0013 Å
• b: 17.3052 ± 0.0011 Å
• c: 14.1228 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5869.8 ± 0.6 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0911
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for significantly intense reflections: 0.1544
• Weighted residual factors for all reflections included in the refinement: 0.1623
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No