Information card for entry 7102397

Structure parameters

• Formula: C28 H37 N O5 Si
• Calculated formula: C28 H37 N O5 Si
• SMILES: o1c(c(C)c2[C@H](OC(=O)c3ccc(N(=O)=O)cc3)[C@@]3(C)[C@H](C)CCC=C3Cc12)[Si](C)(C)C(C)(C)C.o1c(c(C)c2[C@@H](OC(=O)c3ccc(N(=O)=O)cc3)[C@]3(C)[C@@H](C)CCC=C3Cc12)[Si](C)(C)C(C)(C)C
• Title of publication: A new route to furanoeremophilane sesquiterpenoids. Synthesis of (±)-6β-hydroxyeuryopsin
• Authors of publication: Shanmugham, M. Sundaram; White, James D.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2004
• Journal issue: 1
• Pages of publication: 44 - 45
• a: 7.479 ± 0.002 Å
• b: 8.389 ± 0.003 Å
• c: 22.545 ± 0.009 Å
• α: 98.68 ± 0.03°
• β: 99.07 ± 0.03°
• γ: 91.4 ± 0.03°
• Cell volume: 1379.1 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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 all reflections: 0.0803
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for significantly intense reflections: 0.1853
• Weighted residual factors for all reflections included in the refinement: 0.2
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No