Information card for entry 7235702

Structure parameters

• Formula: C12 H13 Cd N2 O5
• Calculated formula: C12 H13 Cd N2 O5
• Title of publication: Effects of substituent groups on the structures and luminescence properties of 2D/3D CdII complexes with mixed rigid and flexible carboxylate ligands
• Authors of publication: Wu, Guo-Yun; Ren, Yi-Xia; Yin, Zheng; Sun, Feng; Zeng, Ming-Hua; Kurmoo, Mohamedally
• Journal of publication: RSC Adv.
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 46
• Pages of publication: 24183
• a: 8.3562 ± 0.0014 Å
• b: 9.3356 ± 0.0016 Å
• c: 9.3443 ± 0.0016 Å
• α: 62.605 ± 0.002°
• β: 89.857 ± 0.003°
• γ: 85.559 ± 0.003°
• Cell volume: 644.81 ± 0.19 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0297
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.0905
• 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: No