Information card for entry 2001407

Structure parameters

• Formula: C9 H16 N3 O5 P
• Calculated formula: C9 H16 N3 O5 P
• Title of publication: Structure of iproniazid phosphate
• Authors of publication: Okabe, N.; Fukuda, H.; Nakamura, T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 9
• Pages of publication: 1677 - 1678
• a: 9.036 ± 0.001 Å
• b: 10.094 ± 0.001 Å
• c: 7.8868 ± 0.0009 Å
• α: 94.11 ± 0.01°
• β: 98.84 ± 0.01°
• γ: 116.556 ± 0.008°
• Cell volume: 627.74 ± 0.13 ų
• Cell temperature: 296 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.046
• Goodness-of-fit parameter for significantly intense reflections: 1.55
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No