Information card for entry 8101210

Structure parameters

• Formula: C25 H34 O3 S Si
• Calculated formula: C25 H34 O3 S Si
• SMILES: [C@H]12[C@@H]([C@H](C[C@H](C1(C)C)C2)[Si](C)(C)c1ccccc1)COS(=O)(=O)c1ccc(cc1)C
• Title of publication: Crystal structure of [3-(dimethylphenylsilyl)-6,6-dimethylbicyclo [3.1.1]hept-2-yl]methyl-toluene-4-sulfonate, C~25~H~34~O~3~Ssi
• Authors of publication: Tinant, Bernard; Declercq, Jean-Paul; Mathieu, Benoit; Ghosez, Leon
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2000
• Journal volume: 215
• Journal issue: 1
• Pages of publication: 175 - 177
• a: 16.054 ± 0.002 Å
• b: 6.486 ± 0.001 Å
• c: 24.04 ± 0.002 Å
• α: 90°
• β: 97.78 ± 0.01°
• γ: 90°
• Cell volume: 2480.2 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No