Information card for entry 1503507

Structure parameters

• Common name: dinaphthylsilanediol with diethyl ether solvate
• Formula: C24 H26 O3 Si
• Calculated formula: C24 H26 O3 Si
• SMILES: [Si](O)(O)(c1cccc2ccccc12)c1cccc2ccccc12.CCOCC
• Title of publication: Cooperative hydrogen-bonding effects in silanediol catalysis.
• Authors of publication: Tran, Ngon T.; Wilson, Sean O.; Franz, Annaliese K.
• Journal of publication: Organic letters
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 1
• Pages of publication: 186 - 189
• a: 8.1046 ± 0.0008 Å
• b: 16.1014 ± 0.0015 Å
• c: 16.2436 ± 0.0016 Å
• α: 80.001 ± 0.001°
• β: 82.991 ± 0.001°
• γ: 83.36 ± 0.001°
• Cell volume: 2062.2 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0497
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0985
• Weighted residual factors for all reflections included in the refinement: 0.1078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No