Information card for entry 2003717

Structure parameters

• Chemical name: 4-benzyl-6-methoxy-3-propylsulfonyl-2-(2,2,2',2'-tetramethyl-[4,4'] bi{[1,3]dioxolanyl}-5-yl)-1-aza-bicyclo[3.2.0]heptane-7-one
• Formula: C27 H39 N O8 S
• Calculated formula: C30 H46 N O8 S
• Title of publication: Two Methyl-Substituted Carbapenem Antibiotic Precursors
• Authors of publication: Chiaroni, A.; Riche, C.; Adonias, M.; Anaya, J.; Géro, S. D.; Tachdjian, C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 7
• Pages of publication: 1306 - 1310
• a: 7.244 ± 0.005 Å
• b: 14.863 ± 0.008 Å
• c: 27.308 ± 0.012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2940 ± 3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.093
• Goodness-of-fit parameter for significantly intense reflections: 1.1
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No