Information card for entry 4114446

Structure parameters

• Formula: C28 H24
• Calculated formula: C28 H24
• SMILES: C\1(=C2/[C@@H](Cc3ccc4ccccc4c23)C)[C@@H](Cc2ccc3ccccc3c12)C.C1(=C2/[C@H](Cc3ccc4ccccc4c23)C)/[C@H](Cc2ccc3ccccc3c12)C
• 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: 10.144 ± 0.001 Å
• b: 15.382 ± 0.002 Å
• c: 13.469 ± 0.002 Å
• α: 90°
• β: 106.173 ± 0.002°
• γ: 90°
• Cell volume: 2018.5 ± 0.4 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 2
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0923
• Residual factor for significantly intense reflections: 0.0824
• Weighted residual factors for significantly intense reflections: 0.205
• Weighted residual factors for all reflections included in the refinement: 0.2161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No