Information card for entry 7204424

Structure parameters

• Common name: japoe09
• Formula: C22 H24
• Calculated formula: C22 H24
• SMILES: c12ccccc1CCCC/C2=C1\c2ccccc2CCCC1
• Title of publication: Cyclic trans-stilbenes: synthesis, structural and spectroscopic characterization, photophysical and photochemical properties
• Authors of publication: Michael Oelgemöller; Bernhard Brem; Rudolf Frank; Siegfried Schneider; Dieter Lenoir; Norbert Hertkorn; Yumi Origane; Peter Lemmen; Johann Lex; Yoshihisa Inoue
• Journal of publication: J. Chem. Soc., Perkin Trans. 2
• Year of publication: 2002
• Journal issue: 10
• Pages of publication: 1760 - 1771
• a: 10.726 ± 0.001 Å
• b: 7.282 ± 0.001 Å
• c: 10.756 ± 0.001 Å
• α: 90°
• β: 106.29 ± 0.01°
• γ: 90°
• Cell volume: 806.39 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0892
• Weighted residual factors for all reflections included in the refinement: 0.0942
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No