Information card for entry 2002906

Structure parameters

• Common name: Lys.3HIO3
• Chemical name: α,ε‒diaminocapronic acid.3HIO~3~
• Formula: C6 H17 I3 N2 O11
• Calculated formula: C6 H17 I3 N2 O11
• SMILES: C(=O)([C@H](CCCC[NH3+])[NH3+])O.[I](=O)(=O)[O-].[I](=O)([O-])(O[I](=O)=O)O
• Title of publication: Interaction of lysine with iodic acid
• Authors of publication: A. M. Petrosyan; R. P. Sukiasyan; S. S. Terzyan; V. M. Burbelo
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 2
• Pages of publication: 221 - 225
• a: 8.36 ± 0.002 Å
• b: 6.33 ± 0.001 Å
• c: 14.75 ± 0.003 Å
• α: 90°
• β: 92.86 ± 0.03°
• γ: 90°
• Cell volume: 779.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0339
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for all reflections: 0.0921
• Weighted residual factors for significantly intense reflections: 0.0918
• Goodness-of-fit parameter for all reflections: 1.071
• Goodness-of-fit parameter for significantly intense reflections: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No