Information card for entry 7004154

Structure parameters

• Common name: cadmiumphosphonate
• Formula: C101 H132 Cd4 O29 P6
• Calculated formula: C101 H132 Cd4 O29 P6
• Title of publication: Assembly of tetra, di and mononuclear molecular cadmium phosphonates using 2,4,6-triisopropylphenylphosponic acid and ancillary ligands
• Authors of publication: Chandrasekhar, Vadapalli; Sasikumar, Palani; Boomishankar, Ramamoorthy
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 38
• Pages of publication: 5189 - 5196
• a: 13.572 ± 0.005 Å
• b: 14.766 ± 0.005 Å
• c: 16.186 ± 0.005 Å
• α: 85.661 ± 0.005°
• β: 80.695 ± 0.005°
• γ: 72.648 ± 0.005°
• Cell volume: 3054.1 ± 1.8 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.063
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1282
• Weighted residual factors for all reflections included in the refinement: 0.1356
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No