Information card for entry 2213118

Structure parameters

• Chemical name: N,N-Dimethylguanidinium chloride
• Formula: C3 H10 Cl N3
• Calculated formula: C3 H10 Cl N3
• SMILES: C(=[NH2+])(N(C)C)N.[Cl-]
• Title of publication: <i>N</i>,<i>N</i>-Dimethylguanidinium chloride
• Authors of publication: Weinmann, Markus; Nuss, Jürgen; Jansen, Martin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: o2767 - o2769
• a: 6.7568 ± 0.0009 Å
• b: 15.732 ± 0.002 Å
• c: 23.364 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2483.5 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 70
• Hermann-Mauguin space group symbol: F d d d :2
• Hall space group symbol: -F 2uv 2vw
• Residual factor for all reflections: 0.0424
• Residual factor for significantly intense reflections: 0.0353
• Weighted residual factors for significantly intense reflections: 0.0808
• Weighted residual factors for all reflections included in the refinement: 0.0845
• Goodness-of-fit parameter for all reflections included in the refinement: 1.174
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes