Information card for entry 7014517

Structure parameters

• Formula: C38 H40 Co2 N4 O7
• Calculated formula: C38 H40 Co2 N4 O7
• SMILES: [Co]1234([N](=C(c5c(cccc5)O2)C)CC(O1)C[N]3=C(c1c(O4)cccc1)C)[O]1[Co]234(Oc5c(cccc5)C(=[N]2CC1C[N]3=C(c1c(O4)cccc1)C)C)[OH2]
• Title of publication: Isolation of four new Co(II)/Co(III) and Ni(II) complexes with a pentadentate Schiff base ligand: syntheses, structural descriptions and magnetic studies.
• Authors of publication: Banerjee, Sambuddha; Nandy, Madhusudan; Sen, Soma; Mandal, Sandip; Rosair, Georgina M.; Slawin, Alexandra M. Z.; Gómez García, Carlos J; Clemente-Juan, Juan M; Zangrando, Ennio; Guidolin, Nicol; Mitra, Samiran
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 8
• Pages of publication: 1652 - 1661
• a: 10.035 ± 0.003 Å
• b: 13.078 ± 0.004 Å
• c: 14.492 ± 0.005 Å
• α: 90.443 ± 0.014°
• β: 100.661 ± 0.012°
• γ: 105.34 ± 0.011°
• Cell volume: 1799.3 ± 1 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 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: 0.1533
• Residual factor for significantly intense reflections: 0.1032
• Weighted residual factors for significantly intense reflections: 0.1486
• Weighted residual factors for all reflections included in the refinement: 0.165
• Goodness-of-fit parameter for all reflections included in the refinement: 1.159
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No