Information card for entry 7237993

Structure parameters

• Chemical name: 3g in manuscript
• Formula: C62 H64
• Calculated formula: C62 H64
• Title of publication: The effect of side-chain length on the microstructure and processing window of zone-cast naphthalene-based bispentalenes
• Authors of publication: Goetz, Katelyn P.; Sekine, Kohei; Paulus, Fabian; Zhong, Yu; Roth, Daniel; Becker-Koch, David; Hofstetter, Yvonne J.; Michel, Elena; Reichert, Lisa; Rominger, Frank; Rudolph, Matthias; Huettner, Sven; Vaynzof, Yana; Herzig, Eva M.; Hashmi, A. Stephen K.; Zaumseil, Jana
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 43
• Pages of publication: 13493
• a: 10.075 ± 0.0004 Å
• b: 14.646 ± 0.0005 Å
• c: 15.682 ± 0.0006 Å
• α: 82.593 ± 0.003°
• β: 78.874 ± 0.003°
• γ: 82.281 ± 0.003°
• Cell volume: 2237.29 ± 0.15 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: 0.095
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.1454
• Weighted residual factors for all reflections included in the refinement: 0.1667
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No