Information card for entry 2003784

Structure parameters

• Common name: 2,6-dichlorophenylguanidinium chloride
• Chemical name: 2,6-dichlorophenylguanidinium chloride
• Formula: C7 H8 Cl3 N3
• Calculated formula: C7 H8 Cl3 N3
• SMILES: [Cl-].Clc1c(NC(=[NH2+])N)c(Cl)ccc1
• Title of publication: 2,6-Dichlorophenylguanidinium Chloride
• Authors of publication: Barker, J.; Powell, H. R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 8
• Pages of publication: 1714 - 1716
• a: 10.3302 ± 0.0003 Å
• b: 10.638 ± 0.0002 Å
• c: 9.7044 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1066.44 ± 0.04 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• 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: 0.0417
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for all reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.0429
• Goodness-of-fit parameter for significantly intense reflections: 1.0991
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No