Information card for entry 7117849

Structure parameters

• Common name: 5 in manuscript
• Formula: C28 H52 N4 Si2
• Calculated formula: C28 H52 N4 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: 7.813 ± 0.0018 Å
• b: 12.886 ± 0.003 Å
• c: 15.976 ± 0.004 Å
• α: 102.557 ± 0.005°
• β: 96.908 ± 0.006°
• γ: 93.896 ± 0.006°
• Cell volume: 1551.2 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.107
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.1219
• Weighted residual factors for all reflections included in the refinement: 0.1387
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No