Crystallography Open Database

Information card for entry 7135120

Preview

Coordinates	7135120.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	SMAH-CN
Formula	C47 H32 N4 O2
Calculated formula	C47 H32 N4 O2
Title of publication	An ultra-simple construction strategy for uncommon 3,4-diaryl-modified maleimide luminophores and their unique aggregation-induced asymmetric effect (AIAE) on conformation.
Authors of publication	Liu, Luyao; Xiao, Chenfa; Li, Yin; Wan, Jiaxing; Tang, Ben Zhong; Wang, Zhiming
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
a	14.78458 ± 0.00018 Å
b	16.90271 ± 0.00016 Å
c	14.64273 ± 0.00019 Å
α	90°
β	108.139 ± 0.0013°
γ	90°
Cell volume	3477.36 ± 0.07 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0409
Residual factor for significantly intense reflections	0.0402
Weighted residual factors for significantly intense reflections	0.0957
Weighted residual factors for all reflections included in the refinement	0.0962
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
303077 (current)	2025-10-29	cif/ Adding structures of 7135119, 7135120 via cif-deposit CGI script.	7135120.cif