Crystallography Open Database

Information card for entry 7235040

Preview

Coordinates	7235040.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52.75 H37.5 Cl1.5
Calculated formula	C52.75 H37.5 Cl1.5
Title of publication	Aggregation-enhanced emission and through-space conjugation of tetraarylethanes and folded tetraarylethenes
Authors of publication	Yingying Zhang; Bairong He; Wenwen Luo; Huiren Peng; Shuming Chen; Rongrong Hu; Anjun Qin; Zujin Zhao; Ben Zhong Tang
Journal of publication	Journal of Materials Chemistry C
Year of publication	2016
Journal volume	4
Pages of publication	9316 - 9324
a	14.0019 ± 0.001 Å
b	14.0989 ± 0.0011 Å
c	20.1686 ± 0.0013 Å
α	78.253 ± 0.003°
β	78.004 ± 0.002°
γ	82.267 ± 0.003°
Cell volume	3795.3 ± 0.5 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1795
Residual factor for significantly intense reflections	0.082
Weighted residual factors for significantly intense reflections	0.1845
Weighted residual factors for all reflections included in the refinement	0.2426
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
227707 (current)	2019-11-13	cif/ Adding structures of 7235040, 7235041, 7235042, 7235043 via cif-deposit CGI script.	7235040.cif