Information card for entry 2203334

Structure parameters

• Chemical name: 5-(8-hydroxyquinolyl)guanidine dihydrochloride
• Formula: C10 H12 Cl2 N4 O
• Calculated formula: C10 H12 Cl2 N4 O
• SMILES: c1ccc2c(ccc(c2[nH+]1)O)NC(=[NH2+])N.[Cl-].[Cl-]
• Title of publication: 5-(8-Hydroxyquinolyl)guanidinium dichloride
• Authors of publication: Wei, Chang-Mei; Jiang, Tao; Li, Yi-Zhi; Zhu, Hong-Jun; Wang, Jin-Tang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 3
• Pages of publication: o442 - o443
• a: 10.715 ± 0.002 Å
• b: 11.333 ± 0.002 Å
• c: 22.72 ± 0.005 Å
• α: 90°
• β: 103.3 ± 0.03°
• γ: 90°
• Cell volume: 2685 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0511
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1369
• Weighted residual factors for all reflections included in the refinement: 0.1386
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No