Crystallography Open Database

Information card for entry 1519689

1519688 << 1519689 >> 1519690

Preview

Coordinates	1519689.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H21 N
Calculated formula	C28 H21 N
Title of publication	Directional Control of π-Conjugation Enabled by Distortion of the Donor Plane in Diarylaminoanthracenes: A Photophysical Study.
Authors of publication	Sasaki, Shunsuke; Hattori, Kengo; Igawa, Kazunobu; Konishi, Gen-Ichi
Journal of publication	The journal of physical chemistry. A
Year of publication	2015
Journal volume	119
Journal issue	20
Pages of publication	4898 - 4906
a	11.152 ± 0.003 Å
b	12.874 ± 0.003 Å
c	13.332 ± 0.003 Å
α	90°
β	90.179 ± 0.006°
γ	90°
Cell volume	1914.1 ± 0.8 Å³
Cell temperature	123 K
Ambient diffraction temperature	123 K
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1449
Residual factor for significantly intense reflections	0.1179
Weighted residual factors for significantly intense reflections	0.1882
Weighted residual factors for all reflections included in the refinement	0.1984
Goodness-of-fit parameter for all reflections included in the refinement	1.246
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
138290 (current)	2015-06-05	cif/ Updating files of 1519689, 1519690 Original log message: Adding full bibliography for 1519689--1519690.cif.	1519689.cif
136823	2015-05-18	cif/ Adding structures of 1519689 via cif-deposit CGI script.	1519689.cif