Information card for entry 2203125

Structure parameters

• Common name: 1,5-Diaminonaphthalene
• Chemical name: 1,5-Diaminonaphthalene
• Formula: C10 H10 N2
• Calculated formula: C10 H10 N2
• SMILES: Nc1cccc2c1cccc2N
• Title of publication: 1,5-Diaminonaphthalene
• Authors of publication: Bernès, Sylvain; Rodríguez Pastrana, Modesto; Huerta Sánchez, Enrique; Gutiérrez Pérez, René
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 1
• Pages of publication: o45 - o47
• a: 5.179 ± 0.0007 Å
• b: 11.0081 ± 0.0018 Å
• c: 21.238 ± 0.003 Å
• α: 90°
• β: 90.679 ± 0.01°
• γ: 90°
• Cell volume: 1210.7 ± 0.3 ų
• Cell temperature: 296 ± 1 K
• Ambient diffraction temperature: 296 ± 1 K
• Number of distinct elements: 3
• 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: 0.081
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.096
• Weighted residual factors for all reflections included in the refinement: 0.118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes