Information card for entry 7243828

Structure parameters

• Formula: C2.82 H1.64 N0.27
• Calculated formula: C2.81818 H1.63636 N0.272727
• Title of publication: Polycyclic motif engineering in cyanostilbene-based donors towards highly efficient modulable emission properties in two-component systems
• Authors of publication: Khan, Arshad; Usman, Rabia; Li, Rongrong; Hajji, Melek; Tang, Haiming; Ma, Di
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 47
• Pages of publication: 8462 - 8470
• a: 9.951 ± 0.005 Å
• b: 11.055 ± 0.004 Å
• c: 11.472 ± 0.006 Å
• α: 61.503 ± 0.013°
• β: 81.14 ± 0.01°
• γ: 82.377 ± 0.01°
• Cell volume: 1093.3 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0888
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.1616
• Weighted residual factors for all reflections included in the refinement: 0.1865
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No