Information card for entry 2206421

Structure parameters

• Formula: C24 H25 Cl2 N5 O8
• Calculated formula: C24 H25 Cl2 N5 O8
• Title of publication: 2-{[<i>N</i>-(Pyridinium-2-ylmethyl)-<i>N</i>-(pyridin-2-ylmethyl)amino]methyl}-1-(pyridin-2-ylmethyl)pyridinium diperchlorate
• Authors of publication: L. Mihiri D. Ariyananda; Richard E. Norman
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 8
• Pages of publication: o2679 - o2681
• a: 13.9313 ± 0.0002 Å
• b: 10.9888 ± 0.0002 Å
• c: 18.128 ± 0.0004 Å
• α: 90°
• β: 108.065 ± 0.0008°
• γ: 90°
• Cell volume: 2638.38 ± 0.09 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0938
• Residual factor for significantly intense reflections: 0.0733
• Weighted residual factors for all reflections: 0.2029
• Weighted residual factors for all reflections included in the refinement: 0.1606
• Goodness-of-fit parameter for all reflections: 0.93605
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0343
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes