Information card for entry 4114447

Structure parameters

• Formula: C28 H24
• Calculated formula: C28 H24
• SMILES: C[C@@H]1Cc2ccc3ccccc3c2C1=C1c2c3ccccc3ccc2C[C@H]1C.C[C@H]1Cc2ccc3ccccc3c2C1=C1c2c3ccccc3ccc2C[C@@H]1C
• Title of publication: Increased Speed of Rotation for the Smallest Light-Driven Molecular Motor
• Authors of publication: Matthijs K. J. ter Wiel; Richard A. van Delden; Auke Meetsma; Ben L. Feringa
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 15076 - 15086
• a: 9.3938 ± 0.0005 Å
• b: 18.939 ± 0.001 Å
• c: 21.924 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3900.5 ± 0.3 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 2
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0504
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.1123
• Weighted residual factors for all reflections included in the refinement: 0.1175
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No