Information card for entry 7012608

Structure parameters

• Formula: C3 H6 Cd N0 O6
• Calculated formula: C3 H6 Cd O6
• Title of publication: Aliphatic dicarboxylates with three-dimensional metal‒organic frameworks possessing hydrophobic channels
• Authors of publication: Vaidhyanathan, Ramanathan; Natarajan, Srinivasan; Rao, C. N. R.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 8
• Pages of publication: 1459
• a: 17.0685 ± 0.0002 Å
• b: 17.0685 ± 0.0002 Å
• c: 12.4302 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3136.17 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for all reflections: 0.0901
• Weighted residual factors for significantly intense reflections: 0.0898
• Goodness-of-fit parameter for all reflections: 1.443
• Goodness-of-fit parameter for significantly intense reflections: 1.456
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No