Information card for entry 4023943

Structure parameters

• Formula: C34 H56 O7 Si
• Calculated formula: C34 H56 O7 Si
• SMILES: C1(=C[C@H](OCOC)[C@@H]2[C@@H](C1)[C@]1([C@H]([C@@H](C2)OCOC)C(=C(C(=O)C1)CCCO)CCO[Si](C(C)C)(C(C)C)C(C)C)C)C
• Title of publication: Toward the Synthesis of Norzoanthamine: Complete Fragment Assembly
• Authors of publication: Martin Juhl; Rune Monrad; Inger Søtofte; David Tanner
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2007
• Journal volume: 72
• Pages of publication: 4644 - 4654
• a: 13.0227 ± 0.0008 Å
• b: 9.1344 ± 0.0006 Å
• c: 14.7121 ± 0.0009 Å
• α: 90°
• β: 94.405 ± 0.002°
• γ: 90°
• Cell volume: 1744.9 ± 0.19 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0996
• Residual factor for significantly intense reflections: 0.0826
• Weighted residual factors for significantly intense reflections: 0.204
• Weighted residual factors for all reflections included in the refinement: 0.217
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No