Information card for entry 4102627

Structure parameters

• Formula: C38 H58 N2 O Si2
• Calculated formula: C38 H58 N2 O Si2
• Title of publication: Arylethynyl Derivatives of the Dihydroazulene/Vinylheptafulvene Photo/Thermoswitch: Tuning the Switching Event
• Authors of publication: Søren Lindbaek Broman; Michael Åxman Petersen; Christian G. Tortzen; Anders Kadziola; Kristine Kilså; Mogens Brøndsted Nielsen
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 9165 - 9174
• a: 7.785 ± 0.0005 Å
• b: 10.978 ± 0.0012 Å
• c: 11.403 ± 0.0011 Å
• α: 95.927 ± 0.007°
• β: 103.375 ± 0.007°
• γ: 96.072 ± 0.008°
• Cell volume: 934.54 ± 0.15 ų
• Cell temperature: 122 ± 2 K
• Ambient diffraction temperature: 122 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1312
• Residual factor for significantly intense reflections: 0.0942
• Weighted residual factors for significantly intense reflections: 0.1911
• Weighted residual factors for all reflections included in the refinement: 0.2159
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No