Information card for entry 8101854

Structure parameters

• Chemical name: diethyl 1-(cyclohexyl carbamoyl)-3-methyl-6-nitro-1H-indene-1,2-dicarboxylate
• Formula: C23 H28 N2 O7
• Calculated formula: C23 H28 N2 O7
• Title of publication: Crystal structure of diethyl 1-(cyclohexyl carbamoyl)-3-methyl-6-nitro- 1~H~-indene-1,2-dicarboxylate, C~23~H~28~N~2~O~7~
• Authors of publication: Zonouzi, A.; Rahmani, H.; Samareh Afsari, H.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2005
• Journal volume: 220
• Journal issue: 4
• Pages of publication: 547 - 548
• a: 9.2002 ± 0.0016 Å
• b: 10.844 ± 0.002 Å
• c: 12.3 ± 0.002 Å
• α: 82.66 ± 0.003°
• β: 82.26 ± 0.004°
• γ: 71.73 ± 0.004°
• Cell volume: 1149.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0874
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.1091
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No