Information card for entry 4116328

Structure parameters

• Common name: THP(gly)3
• Formula: C9 H23 Cl3 N3 O7 P
• Calculated formula: C9 H23 Cl3 N3 O7 P
• Title of publication: Chemical and Biomedical Motifs of the Reactions of Hydroxymethylphosphines with Amines, Amino Acids, and Model Peptides
• Authors of publication: Douglas E. Berning; Kattesh V. Katti; Charles L. Barnes; Wynn A. Volkert
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1999
• Journal volume: 121
• Pages of publication: 1658 - 1664
• a: 6.8627 ± 0.0008 Å
• b: 9.354 ± 0.002 Å
• c: 14.486 ± 0.004 Å
• α: 84.51 ± 0.03°
• β: 77.44 ± 0.02°
• γ: 86.25 ± 0.03°
• Cell volume: 902.5 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.039
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for all reflections: 0.073
• Weighted residual factors for significantly intense reflections: 0.073
• Goodness-of-fit parameter for significantly intense reflections: 2.85
• Diffraction radiation wavelength: 1.54056 Å
• Diffraction radiation type: CopperKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No