Crystallography Open Database

Information card for entry 1515267

Preview

Coordinates	1515267.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H28 N6 Si
Calculated formula	C32 H28 N6 Si
Title of publication	What makes efficient circularly polarised luminescence in the condensed phase: aggregation-induced circular dichroism and light emission
Authors of publication	Liu, Jianzhao; Su, Huimin; Meng, Luming; Zhao, Yihua; Deng, Chunmei; Ng, Jason C. Y.; Lu, Ping; Faisal, Mahtab; Lam, Jacky W. Y.; Huang, Xuhui; Wu, Hongkai; Wong, Kam Sing; Tang, Ben Zhong
Journal of publication	Chemical Science
Year of publication	2012
Journal volume	3
Journal issue	9
Pages of publication	2737
a	20.8494 ± 0.0019 Å
b	10 ± 0.0007 Å
c	13.5537 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	2825.9 ± 0.4 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 K
Number of distinct elements	4
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0588
Residual factor for significantly intense reflections	0.0413
Weighted residual factors for significantly intense reflections	0.1049
Weighted residual factors for all reflections included in the refinement	0.1148
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1515267.cif
110921	2014-04-20	cif/ Adding structures of 1515267 via cif-deposit CGI script.	1515267.cif