Crystallography Open Database

Information card for entry 7238974

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Structure parameters

Formula	C34 H24
Calculated formula	C34 H24
Title of publication	Substitution position tuning of the different aggregation-induced emission properties of four (1-naphthyl)vinyl(9-anthryl)vinylbenzene isomers: from ACQ to AIEE and AIE
Authors of publication	Li, Ye-Xin; Pang, Mao-Ping; Zhang, Zhen-Wei; Li, Guo-Bao; Sun, Guo-Xin
Journal of publication	RSC Advances
Year of publication	2013
Journal volume	3
Journal issue	35
Pages of publication	14950
a	16.85 ± 0.004 Å
b	6.4351 ± 0.0018 Å
c	22.782 ± 0.006 Å
α	90°
β	107.41 ± 0.03°
γ	90°
Cell volume	2357.1 ± 1.1 Å³
Cell temperature	291.15 K
Ambient diffraction temperature	291.15 K
Number of distinct elements	2
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	0.21
Residual factor for significantly intense reflections	0.0718
Weighted residual factors for significantly intense reflections	0.1227
Weighted residual factors for all reflections included in the refinement	0.1774
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301866 (current)	2025-08-23	Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure.	7238974.cif
244487	2019-11-28	cif/ Adding structures of 7238974, 7238975 via cif-deposit CGI script.	7238974.cif