Crystallography Open Database

Information card for entry 1504364

Preview

Coordinates	1504364.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H21 N O
Calculated formula	C31 H21 N O
SMILES	c1ccc2c(c1)C(=O)c1c2ccc(c1)c1ccc(cc1)N(c1ccccc1)c1ccccc1
Title of publication	Aggregation-Induced Emissions of Fluorenonearylamine Derivatives: A New Kind of Materials for Nondoped Red Organic Light-Emitting Diodes
Authors of publication	Liu, Y.; Tao, X.; Wang, F.; Dang, X.; Zou, D.; Ren, Y.; Jiang, M.
Journal of publication	Journal of Physical Chemistry C
Year of publication	2008
Journal volume	112
Journal issue	10
Pages of publication	3975
a	18.807 ± 0.005 Å
b	8.584 ± 0.005 Å
c	16.555 ± 0.005 Å
α	90 ± 0.005°
β	115.041 ± 0.005°
γ	90 ± 0.005°
Cell volume	2421.4 ± 1.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.241
Residual factor for significantly intense reflections	0.1645
Weighted residual factors for significantly intense reflections	0.4273
Weighted residual factors for all reflections included in the refinement	0.4718
Goodness-of-fit parameter for all reflections included in the refinement	1.496
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
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.	1504364.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1504364.cif
41988	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 1504364 via cif-deposit CGI script.	1504364.cif