Information card for entry 4340702

Structure parameters

• Formula: C34 H42 Cu2 N10 O2
• Calculated formula: C34 H42 Cu2 N10 O2
• SMILES: c12c3ccccc3ccc1C(=[N]1CCC[N](C)(C)[Cu]31(O2)[N](=N#N)[Cu]12([N]3=N#N)[N](=C(c3c(c4ccccc4cc3)O2)C)CCC[N]1(C)C)C
• Title of publication: Field-Induced Ferromagnetism and Multiferroic Behavior in End-on Pseudohalide-Bridged Dinuclear Copper(II) Complexes with Tridentate Schiff Base Blocking Ligands.
• Authors of publication: Jana, Subrata; Shaw, Bikash Kumar; Bhowmik, Prasanta; Harms, Klaus; Drew, Michael G. B.; Chattopadhyay, Shouvik; Saha, Shyamal Kumar
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 16
• Pages of publication: 8723 - 8734
• a: 10.4117 ± 0.0004 Å
• b: 14.8906 ± 0.0006 Å
• c: 11.9038 ± 0.0005 Å
• α: 90°
• β: 113.976 ± 0.005°
• γ: 90°
• Cell volume: 1686.28 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0478
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0914
• Weighted residual factors for all reflections included in the refinement: 0.0971
• Goodness-of-fit parameter for all reflections included in the refinement: 0.937
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No