Information card for entry 2200825

Structure parameters

• Formula: C18 H16
• Calculated formula: C18 H16
• SMILES: C1(=C2\CCc3ccccc23)\CCc2ccccc12
• Title of publication: (<i>Z</i>)-2,3,2',3'-Tetrahydro-[1,1']biindenylidene
• Authors of publication: Jovanovic, Jovan; Elling, Wilhelm; Schürmann, Markus; Preut, Hans; Spiteller, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 1
• Pages of publication: o35 - o36
• a: 14.7176 ± 0.0002 Å
• b: 14.768 ± 0.0002 Å
• c: 23.586 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5126.41 ± 0.12 ų
• Cell temperature: 291 ± 1 K
• Ambient diffraction temperature: 291 ± 1 K
• Number of distinct elements: 2
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0909
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1106
• Goodness-of-fit parameter for all reflections included in the refinement: 0.913
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes