Information card for entry 7018039

Structure parameters

• Formula: C30 H39 Co N2 O8
• Calculated formula: C30 H39 Co N2 O8
• SMILES: [Co]123([N]([C@@H]4[C@@H]([N]1=Cc1c(O3)c(cc(c1)C)C)CCCC4)=Cc1c(O2)c(cc(c1)C)C)(OC(=O)C)[O]=C(O)C.OC(=O)C.[Co]123([N]([C@H]4[C@H]([N]1=Cc1c(O3)c(cc(c1)C)C)CCCC4)=Cc1c(O2)c(cc(c1)C)C)(OC(=O)C)[O]=C(O)C.OC(=O)C
• Title of publication: Unusual coordination mode of tetradentate Schiff base cobalt(iii) complexes.
• Authors of publication: Cyriac, Anish; Jeon, Jong Yeob; Varghese, Jobi Kodiyan; Park, Ji Hae; Choi, Soo Young; Chung, Young Keun; Lee, Bun Yeoul
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 5
• Pages of publication: 1444 - 1447
• a: 11.669 ± 0.0006 Å
• b: 17.5399 ± 0.0013 Å
• c: 16.0611 ± 0.0011 Å
• α: 90°
• β: 110.763 ± 0.004°
• γ: 90°
• Cell volume: 3073.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0957
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.1623
• Weighted residual factors for all reflections included in the refinement: 0.1813
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No