Information card for entry 7034642

Structure parameters

• Formula: C22 H32 Cl4 Cu2 N4 O2
• Calculated formula: C22 H32 Cl4 Cu2 N4 O2
• SMILES: C(CCCC[N]1=Cc2[n]([Cu]31(Cl)[Cl][Cu]1([n]4c(C=[N]1CCCCCO)cccc4)(Cl)[Cl]3)cccc2)O
• Title of publication: Doubly chloro bridged dimeric copper(ii) complex: magneto-structural correlation and anticancer activity.
• Authors of publication: Sikdar, Yeasin; Modak, Ritwik; Bose, Dipayan; Banerjee, Saswati; Bieńko, Dariusz; Zierkiewicz, Wiktor; Bieńko, Alina; Das Saha, Krishna; Goswami, Sanchita
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 19
• Pages of publication: 8876 - 8888
• a: 9.1653 ± 0.0005 Å
• b: 7.2194 ± 0.0004 Å
• c: 20.4311 ± 0.0011 Å
• α: 90°
• β: 93.455 ± 0.002°
• γ: 90°
• Cell volume: 1349.43 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0515
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.1584
• Weighted residual factors for all reflections included in the refinement: 0.1688
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No