Information card for entry 2200438

Structure parameters

• Common name: Hydrogen bis[L-lysinium(2+)] dichloride perchlorate
• Chemical name: Hydrogen bis[L-lysinium(2+)] dichloride perchlorate
• Formula: C12 H31 Cl3 N4 O8
• Calculated formula: C12 H31 Cl3 N4 O8
• SMILES: Cl(=O)(=O)(=O)[O-].[Cl-].[Cl-].O=C([O-])[C@@H]([NH3+])CCCC[NH3+].O=C(O)[C@@H]([NH3+])CCCC[NH3+]
• Title of publication: Hydrogen bis[<small>L</small>-lysinium(2+)] dichloride perchlorate
• Authors of publication: Srinivasan, N.; Sridhar, B.; Rajaram, R. K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 9
• Pages of publication: o875 - o877
• a: 5.0264 ± 0.0006 Å
• b: 20.822 ± 0.002 Å
• c: 20.897 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2187.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.081
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for all reflections included in the refinement: 0.196
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No