Information card for entry 7243113

Structure parameters

• Formula: C47 H33 F N2
• Calculated formula: C47 H33 F N2
• Title of publication: Investigating the structure‒fluorescence properties of tetraphenylethylene fused imidazole AIEgens: reversible mechanofluorochromism and polymer matrix controlled fluorescence tuning
• Authors of publication: Nagarasu, Palaniyappan; Kundu, Anu; Thiruvenkatam, Vijay; Raghavaiah, Pallepogu; Anthony, Savarimuthu Philip; Madhu, Vedichi
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 31
• Pages of publication: 5403 - 5410
• a: 9.3263 ± 0.001 Å
• b: 10.8791 ± 0.0012 Å
• c: 19.822 ± 0.002 Å
• α: 98.441 ± 0.004°
• β: 94.465 ± 0.003°
• γ: 114.358 ± 0.003°
• Cell volume: 1790.8 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.172
• Residual factor for significantly intense reflections: 0.1461
• Weighted residual factors for significantly intense reflections: 0.4138
• Weighted residual factors for all reflections included in the refinement: 0.4278
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No