Information card for entry 2210214

Structure parameters

• Common name: Acetophenonaminoguanidine
• Chemical name: 2-(1-Phenylethylideneamino)guanidine
• Formula: C9 H12 N4
• Calculated formula: C9 H12 N4
• SMILES: C(N)(=N\N=C(/C)c1ccccc1)N
• Title of publication: 2-(1-Phenylethylideneamino)guanidine
• Authors of publication: Demir, Sibel; Dinçer, Muharrem; Sarıpınar, Emin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: o4194 - o4195
• a: 8.2673 ± 0.0009 Å
• b: 9.0198 ± 0.0007 Å
• c: 26.565 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1980.9 ± 0.3 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 3
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.089
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes