Information card for entry 7251760

Structure parameters

• Formula: C34 H53 N2 O16 P5
• Calculated formula: C34 H53 N2 O16 P5
• Title of publication: Directing alendronate structures into 2-D layers with bulky quaternary phosphonium cations
• Authors of publication: Forsyth, Craig M.; Deacon, Glen B.; Junk, Peter C.
• Journal of publication: CrystEngComm
• Year of publication: 2026
• a: 9.5185 ± 0.0001 Å
• b: 13.6577 ± 0.0002 Å
• c: 17.1463 ± 0.0002 Å
• α: 82.157 ± 0.001°
• β: 74.606 ± 0.001°
• γ: 76.575 ± 0.001°
• Cell volume: 2083.67 ± 0.05 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0398
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0921
• Weighted residual factors for all reflections included in the refinement: 0.0949
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No