Information card for entry 8101197

Structure parameters

• Formula: C23 H44 O5 Si
• Calculated formula: C23 H44 O5 Si
• SMILES: [Si](O[C@H]1C[C@]2([C@@]3(OC)[C@H]([C@@](C1)(O2)C)[C@@H](O)[C@H](O)CC3)C)(C(C)C)(C(C)C)C(C)C.[Si](O[C@@H]1C[C@@]2([C@]3(OC)[C@@H]([C@](C1)(O2)C)[C@H](O)[C@@H](O)CC3)C)(C(C)C)(C(C)C)C(C)C
• Title of publication: Crystal structure of 1,8-dimethyl-7α-methoxy-10α-(triisopropylsilyloxy)- (2β)-12-oxatricyclo[6.3.1.0^2,7^]dodecane-3β,4α- diol, [(C~3~H~7~)~3~SiO](CH~3~)~2~(OH)~2~(OCH~3~)(C~11~H~12~O)
• Authors of publication: Wittenberg, J.; Wartchow, Rudolf; Hoffmann, H. M. R.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2000
• Journal volume: 215
• Journal issue: 1
• Pages of publication: 153 - 154
• a: 13.117 ± 0.002 Å
• b: 8.736 ± 0.001 Å
• c: 22.362 ± 0.003 Å
• α: 90°
• β: 101.36 ± 0.02°
• γ: 90°
• Cell volume: 2512.3 ± 0.6 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.0597
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No