Crystallography Open Database

Information card for entry 1575432

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Coordinates	1575432.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H15 F4 N3
Calculated formula	C27 H15 F4 N3
Title of publication	Donor–acceptor architecture dictates emission properties: enhanced solid-state fluorescence in carbazole-based charge transfer cocrystals
Authors of publication	Usman, Rabia; Jiang, Zhouyu; Kuznetsov, Aleksey; Henidi, Hanan A.; Altamimi, Abeer A.; Bin-Jumah, May Nasser; Alghamdi, Mutaz; Khan, Arshad
Journal of publication	CrystEngComm
Year of publication	2025
Journal volume	27
Journal issue	38
Pages of publication	6303 - 6313
a	15.571 ± 0.012 Å
b	12.724 ± 0.01 Å
c	13.505 ± 0.011 Å
α	90°
β	125.2°
γ	90°
Cell volume	2186 ± 3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1263
Residual factor for significantly intense reflections	0.0556
Weighted residual factors for significantly intense reflections	0.1211
Weighted residual factors for all reflections included in the refinement	0.1556
Goodness-of-fit parameter for all reflections included in the refinement	1.078
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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