Information card for entry 2010493

Structure parameters

• Formula: C6 H2 Cl3 N O2
• Calculated formula: C6 H2 Cl3 N O2
• Title of publication: Three Polychloromononitrobenzenes: C~6~H~3~Cl~2~NO~2~, C~6~H~2~Cl~3~NO~2~ and C~6~HCl~4~NO~2~
• Authors of publication: Bhar, Abdenbi; Aune, Jean Pierre; Benali-Cherif, Nourredine; Benmenni, Leila; Giorgi, Michel
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 2
• Pages of publication: 256 - 260
• a: 7.842 ± 0.002 Å
• b: 14.45 ± 0.005 Å
• c: 7.548 ± 0.002 Å
• α: 101.08 ± 0.02°
• β: 98.1 ± 0.02°
• γ: 84.38 ± 0.03°
• Cell volume: 828.8 ± 0.4 ų
• Cell temperature: 293 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: 0.06
• Weighted residual factors for significantly intense reflections: 0.08
• Goodness-of-fit parameter for significantly intense reflections: 3.086
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No