Information card for entry 7002819

Structure parameters

• Formula: C48 H49 Cl2 N6 O15 P V2
• Calculated formula: C48 H49 Cl2 N6 O15 P V2
• Title of publication: Selective recognition and binding of arsenate over phosphate
• Authors of publication: Egdal, Rune Kirk; Raber, Georg; Bond, Andrew D.; Hussain, Munawar; Espino, Maria P. B.; Francesconi, Kevin A.; McKenzie, Christine J.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 44
• Pages of publication: 9718 - 9721
• a: 34.3754 ± 0.0012 Å
• b: 34.3754 ± 0.0012 Å
• c: 24.9569 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 25539.8 ± 1.5 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 7
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0664
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1264
• Weighted residual factors for all reflections included in the refinement: 0.1339
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No