Information card for entry 2000478

Structure parameters

• Formula: C7 H7 N3 O
• Calculated formula: C7 H7 N3 O
• SMILES: NC(=O)/N=N/c1ccccc1
• Title of publication: Structure of phenylazocarboxamide
• Authors of publication: Okabe, N.; Kisaichi, H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 11
• Pages of publication: 2047 - 2049
• a: 5.187 ± 0.003 Å
• b: 14.362 ± 0.005 Å
• c: 19.845 ± 0.004 Å
• α: 90°
• β: 93.42 ± 0.04°
• γ: 90°
• Cell volume: 1475.7 ± 1 ų
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No