Information card for entry 7222048

Structure parameters

• Formula: C14 H26 Cd3 N2 O12 P2
• Calculated formula: C14 H26 Cd3 N2 O12 P2
• Title of publication: Two novel cadmium(II) carboxyphosphonates with 3D framework structure: syntheses, crystal structures, luminescence and molecular recognition properties
• Authors of publication: Ma, Chao; Jiao, Cheng‒Qi; Sun, Zhen-Gang; Zhu, Yanyu; Zhang, Xiao-Wen; Wang, Mei-Ling; Yang, Dan; Zhao, Zhou; Li, Huan-Yu; Xing, Bo
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 22.4941 ± 0.0015 Å
• b: 11.1377 ± 0.0008 Å
• c: 9.8101 ± 0.0007 Å
• α: 90°
• β: 103.1 ± 0.001°
• γ: 90°
• Cell volume: 2393.8 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0299
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0833
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No