Information card for entry 7117853

Structure parameters

• Common name: 15 in manuscript
• Formula: C56 H58 N4 O Si2
• Calculated formula: C56 H58 N4 O Si2
• Title of publication: Bisalkynylated 3,6-diiminocyclohexa-1,4-diene-1,4-diamine
• Authors of publication: Philipp Biegger; Manuel Schaffroth; Kerstin Brodner; Olena Tverskoy; Frank Rominger; Uwe H. F. Bunz
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 14844
• a: 37.073 ± 0.004 Å
• b: 11.0554 ± 0.0013 Å
• c: 26.576 ± 0.003 Å
• α: 90°
• β: 118.358 ± 0.003°
• γ: 90°
• Cell volume: 9585.2 ± 1.9 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1588
• Residual factor for significantly intense reflections: 0.0746
• Weighted residual factors for significantly intense reflections: 0.1518
• Weighted residual factors for all reflections included in the refinement: 0.1934
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No