Information card for entry 2016107

Structure parameters

• Chemical name: bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')(imidazolidine-2-thione- κ<i>S</i>)copper(II) bis(perchlorate)
• Formula: C23 H22 Cl2 Cu N6 O8 S
• Calculated formula: C23 H22 Cl2 Cu N6 O8 S
• SMILES: [Cu]12([S]=C3NCCN3)([n]3ccccc3c3[n]1cccc3)[n]1ccccc1c1[n]2cccc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
• Title of publication: (1,3-Dimethylimidazolidine-2-selone-κ<i>Se</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(perchlorate) and bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')(imidazolidine-2-thione-κ<i>S</i>)copper(II) bis(perchlorate)
• Authors of publication: Blake, Alexander J.; Lippolis, Vito; Pivetta, Tiziana; Verani, Gaetano
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: m364 - m367
• a: 11.493 ± 0.007 Å
• b: 11.861 ± 0.009 Å
• c: 20.166 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2749 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0723
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.15
• Weighted residual factors for all reflections included in the refinement: 0.164
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes