Information card for entry 7216769

Structure parameters

• Common name: coordination Polymer
• Formula: C18 H16 N4 O6 S Zn
• Calculated formula: C18 H12 N4 O6 S Zn
• Title of publication: Structural diversity and luminescence properties of coordination polymers based on mixed ligands, 2,5-bis(imidazol-1-yl)thiophene (thim2) and aromatic multicarboxylates
• Authors of publication: Singh, Namita; Anantharaman, Ganapathi
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 34
• Pages of publication: 7914
• a: 9.961 ± 0.005 Å
• b: 17.323 ± 0.004 Å
• c: 10.814 ± 0.005 Å
• α: 90°
• β: 94.871 ± 0.005°
• γ: 90°
• Cell volume: 1859.3 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.074
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1315
• Weighted residual factors for all reflections included in the refinement: 0.1822
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No