Information card for entry 7239382

Structure parameters

• Formula: C25 H25 Br Cu N4 O5
• Calculated formula: C25 H25 Br Cu N4 O5
• Title of publication: Structural and functional studies on ternary coordination polymers from 5-bromoisophthalate and imidazole based flexible linker
• Authors of publication: Bisht, Kamal Kumar; Rachuri, Yadagiri; Parmar, Bhavesh; Suresh, Eringathodi
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 14
• Pages of publication: 7352
• a: 9.298 ± 0.003 Å
• b: 10.903 ± 0.003 Å
• c: 13.375 ± 0.004 Å
• α: 75.732 ± 0.005°
• β: 76.533 ± 0.005°
• γ: 70.13 ± 0.005°
• Cell volume: 1219.2 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0776
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.1172
• Weighted residual factors for all reflections included in the refinement: 0.1269
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No