Information card for entry 2004228

Structure parameters

• Chemical name: 2,6-Dimethyl-3,5-dimethoxycarbonyl-4-(2-nitrosophenyl)pyridine
• Formula: C17 H16 N2 O5
• Calculated formula: C17 H16 N2 O5
• Title of publication: 3,5-Dimethoxycarbonyl-2,6-dimethyl-4-(2-nitrosophenyl)pyridine and Dichlorobis[3,5-dimethoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)pyridine]copper(II)
• Authors of publication: Rowan, K. R.; Holt, E. M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 12
• Pages of publication: 2554 - 2559
• a: 18.171 ± 0.004 Å
• b: 7.157 ± 0.001 Å
• c: 26.165 ± 0.005 Å
• α: 90°
• β: 90.2 ± 0.03°
• γ: 90°
• Cell volume: 3402.7 ± 1.1 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• 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
• Residual factor for all reflections: 0.2602
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for all reflections: 0.158
• Weighted residual factors for significantly intense reflections: 0.1
• Goodness-of-fit parameter for all reflections: 0.694
• Goodness-of-fit parameter for significantly intense reflections: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No