Information card for entry 4127401

Structure parameters

• Common name: SVK4_120
• Chemical name: SVK4_173
• Formula: C28 H16
• Calculated formula: C28 H16
• SMILES: c12c3cc(C#Cc4cccc(c4)c4cc(ccc4)C#Cc(ccc1)c2)ccc3
• Title of publication: Templated Synthesis of End-Functionalized Graphene Nanoribbons through Living Ring-Opening Alkyne Metathesis Polymerization.
• Authors of publication: von Kugelgen, Stephen; Piskun, Ilya; Griffin, James H.; Eckdahl, Christopher T.; Jarenwattananon, Nanette N.; Fischer, Felix R.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 28
• Pages of publication: 11050 - 11058
• a: 5.5153 ± 0.0002 Å
• b: 15.9898 ± 0.0007 Å
• c: 20.1319 ± 0.0005 Å
• α: 87.836 ± 0.003°
• β: 86.477 ± 0.003°
• γ: 89.047 ± 0.004°
• Cell volume: 1770.6 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 2
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0645
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1378
• Weighted residual factors for all reflections included in the refinement: 0.1496
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No