Information card for entry 7006560

Structure parameters

• Common name: Compound 2
• Formula: C24 H34 Cd2 Cl2 N4 O4
• Calculated formula: C24 H34 Cd2 Cl2 N4 O4
• SMILES: [Cd]123(Cl)[O]4[Cd]5(Cl)([O]1c1c(cccc1OC)C=[N]3CC[N]2(C)C)[N](C)(CC[N]5=Cc1c4c(OC)ccc1)C
• Title of publication: Ligating properties of a potentially tetradentate Schiff base [(CH3)2NCH2CH2N=CHC6H3(OH)(OMe)] with zinc(II), cadmium(II), cobalt(II), cobalt(III) and manganese(III) ions: synthesis and structural studies.
• Authors of publication: Sen, Soma; Talukder, Pritha; Dey, Subrata K.; Mitra, Samiran; Rosair, Georgina; Hughes, David L.; Yap, Glenn P. A.; Pilet, Guillaume; Gramlich, V.; Matsushita, T.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 14
• Pages of publication: 1758 - 1767
• a: 15.373 ± 0.008 Å
• b: 14.399 ± 0.007 Å
• c: 14.621 ± 0.009 Å
• α: 90°
• β: 112.94 ± 0.04°
• γ: 90°
• Cell volume: 2980 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0489
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for all reflections: 0.1227
• Weighted residual factors for significantly intense reflections: 0.1193
• Goodness-of-fit parameter for all reflections: 1.046
• Goodness-of-fit parameter for significantly intense reflections: 1.062
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No