Information card for entry 2009371

Structure parameters

• Formula: C22 H39 N O8
• Calculated formula: C22 H39 N O8
• Title of publication: Di-<i>tert</i>-butyl 4-[2-(<i>tert</i>-butoxycarbonyl)ethyl]-4-nitroheptanedioate, C~22~H~39~NO~8~
• Authors of publication: Newkome, G.R.; Behera, R.K.; Baker, G.R.; Fronczek, F.R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 1
• Pages of publication: 120 - 122
• a: 11.552 ± 0.002 Å
• b: 22.165 ± 0.001 Å
• c: 20.89 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5348.9 ± 1.1 ų
• Cell temperature: 298 K
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.09
• Goodness-of-fit parameter for significantly intense reflections: 4.092
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No