Information card for entry 2238137

Structure parameters

• Chemical name: Bis{2-[(5-hydroxypentyl)iminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>^1^}copper(II)
• Formula: C24 H32 Cu N2 O4
• Calculated formula: C24 H32 Cu N2 O4
• SMILES: O1c2c(C=[N]([Cu]31[N](=Cc1c(cccc1)O3)CCCCCO)CCCCCO)cccc2
• Title of publication: Bis{2-[(5-hydroxypentyl)iminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>^1^}copper(II)
• Authors of publication: Modak, Ritwik; Patra, Santu; Mandal, Senjuti; Sikdar, Yeasin; Goswami, Sanchita
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 7
• Pages of publication: m412 - m413
• a: 11.8815 ± 0.0008 Å
• b: 5.2219 ± 0.0003 Å
• c: 18.9588 ± 0.0012 Å
• α: 90°
• β: 102.876 ± 0.002°
• γ: 90°
• Cell volume: 1146.7 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0355
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.0957
• Goodness-of-fit parameter for all reflections included in the refinement: 0.947
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes