Crystallography Open Database

Information card for entry 1517927

Preview

Coordinates	1517927.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	4,4'-Didodecyloxy-3-methylazobenzene
Formula	C37 H60 N2 O2
Calculated formula	C37 H60 N2 O2
SMILES	c1(ccc(cc1)OCCCCCCCCCCCC)N=Nc1cc(c(cc1)OCCCCCCCCCCCC)C
Title of publication	Photoinduced Crystal-to-Liquid Phase Transitions of Azobenzene Derivatives and Their Application in Photolithography Processes through a Solid-Liquid Patterning.
Authors of publication	Norikane, Yasuo; Uchida, Emi; Tanaka, Satoko; Fujiwara, Kyoko; Koyama, Emiko; Azumi, Reiko; Akiyama, Haruhisa; Kihara, Hideyuki; Yoshida, Masaru
Journal of publication	Organic letters
Year of publication	2014
Journal volume	16
Journal issue	19
Pages of publication	5012 - 5015
a	7.483 ± 0.002 Å
b	9.48 ± 0.003 Å
c	24.88 ± 0.007 Å
α	90°
β	97.096 ± 0.003°
γ	90°
Cell volume	1751.4 ± 0.9 Å³
Cell temperature	183 ± 2 K
Ambient diffraction temperature	183 ± 2 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0867
Residual factor for significantly intense reflections	0.0496
Weighted residual factors for significantly intense reflections	0.1431
Weighted residual factors for all reflections included in the refinement	0.2018
Goodness-of-fit parameter for all reflections included in the refinement	0.948
Diffraction radiation wavelength	0.71073 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.	1517927.cif
124611	2014-10-06	cif/ Adding structures of 1517926, 1517927, 1517928, 1517929, 1517930 via cif-deposit CGI script.	1517927.cif