Crystallography Open Database

Information card for entry 8000488

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Coordinates	8000488.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H16 N2
Calculated formula	C25 H16 N2
Title of publication	Aromatic Electrophilic Directing for Fluorescence and Room-Temperature Phosphorescence Modulation.
Authors of publication	Nie, Xiancheng; Su, Hao; Wang, Tao; Miao, Hui; Chen, Biao; Zhang, Guoqing
Journal of publication	The journal of physical chemistry letters
Year of publication	2021
Journal volume	12
Journal issue	12
Pages of publication	3099 - 3105
a	31.8745 ± 0.0012 Å
b	31.8745 ± 0.0012 Å
c	10.1687 ± 0.0005 Å
α	90°
β	90°
γ	120°
Cell volume	8947.1 ± 0.6 Å³
Cell temperature	290 ± 2 K
Ambient diffraction temperature	290 ± 2 K
Number of distinct elements	3
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.082
Residual factor for significantly intense reflections	0.0477
Weighted residual factors for significantly intense reflections	0.1132
Weighted residual factors for all reflections included in the refinement	0.128
Goodness-of-fit parameter for all reflections included in the refinement	0.979
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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