Crystallography Open Database

Information card for entry 2240648

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Structure parameters

Common name	(E,E)-thiene-2,5-diylbis[N-(4-methylphenyl)methanimine]
Chemical name	<i>N</i>,<i>N</i>'-[(Thiophene-2,5-diyl)bis(methanylylidene)]di-<i>p</i>-toluidine
Formula	C20 H18 N2 S
Calculated formula	C20 H18 N2 S
SMILES	s1c(ccc1/C=N/c1ccc(cc1)C)/C=N/c1ccc(cc1)C
Title of publication	Crystal structure of <i>N</i>,<i>N</i>'-[(thiophene-2,5-diyl)bis(methanylylidene)]di-<i>p</i>-toluidine
Authors of publication	Boyle, Raina; Crundwell, Guy; Glagovich, Neil M.
Journal of publication	Acta Crystallographica Section E
Year of publication	2015
Journal volume	71
Journal issue	6
Pages of publication	o403
a	37.166 ± 0.002 Å
b	6.0292 ± 0.0002 Å
c	7.5814 ± 0.0004 Å
α	90°
β	93.452 ± 0.007°
γ	90°
Cell volume	1695.77 ± 0.14 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0662
Residual factor for significantly intense reflections	0.0482
Weighted residual factors for significantly intense reflections	0.1295
Weighted residual factors for all reflections included in the refinement	0.1445
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181906 (current)	2016-04-06	hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/06	2240648.cif 2240648.hkl
136438	2015-05-13	cif/ hkl/ Adding structures of 2240648 via cif-deposit CGI script.	2240648.cif 2240648.hkl