Information card for entry 7122688

Structure parameters

• Formula: C44.46 H55.93 Cl0.93 N5
• Calculated formula: C44.463 H55.926 Cl0.926 N5
• Title of publication: Ion-pairing assemblies based on π-extended dipyrrolylquinoxalines
• Authors of publication: Yamakado, Ryohei; Ishibashi, Haruna; Motoyoshi, Yukari; Yasuda, Nobuhiro; Maeda, Hiromitsu
• Journal of publication: Chemical Communications
• Year of publication: 2018
• a: 22.064 ± 0.003 Å
• b: 8.4746 ± 0.0009 Å
• c: 21.388 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3999.2 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.189
• Residual factor for significantly intense reflections: 0.0607
• Weighted residual factors for significantly intense reflections: 0.114
• Weighted residual factors for all reflections included in the refinement: 0.1431
• Goodness-of-fit parameter for all reflections included in the refinement: 0.812
• Diffraction radiation wavelength: 0.7007 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No