Information card for entry 7217043

Structure parameters

• Common name: [Cu2(4,4'-bpy)(Hser-5-NO2-sal)2].3DMSO
• Formula: C36 H46 Cu2 N6 O15 S3
• Calculated formula: C36 H40 Cu2 N6 O15 S3
• Title of publication: Hierarchical importance of coordination and hydrogen bonds in the formation of homochiral 2D coordination polymers and 2D supramolecular assemblies
• Authors of publication: Kumar, Navnita; Khullar, Sadhika; Singh, Yogesh; Mandal, Sanjay K.
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 29
• Pages of publication: 6730
• a: 23.4854 ± 0.0018 Å
• b: 6.8789 ± 0.0005 Å
• c: 13.6839 ± 0.0011 Å
• α: 90°
• β: 101.685 ± 0.004°
• γ: 90°
• Cell volume: 2164.9 ± 0.3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0654
• Residual factor for significantly intense reflections: 0.0494
• Weighted residual factors for significantly intense reflections: 0.1315
• Weighted residual factors for all reflections included in the refinement: 0.1451
• Goodness-of-fit parameter for all reflections included in the refinement: 0.935
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No