Information card for entry 5000177

Structure parameters

• Formula: C6 H5 N O3
• Calculated formula: C6 H5 N O3
• Title of publication: Charge Density Study of the Polymorphs of p-Nitrophenol
• Authors of publication: Kulkarni, G. U.; Kumaradhas, P.; Rao, C. N. R.
• Journal of publication: Chemistry of Materials
• Year of publication: 1998
• Journal volume: 10
• Pages of publication: 3498 - 3505
• a: 6.1664 ± 0.0001 Å
• b: 8.8366 ± 0.0003 Å
• c: 11.5435 ± 0.0004 Å
• α: 90°
• β: 103.39 ± 0.001°
• γ: 90°
• Cell volume: 611.91 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No