Crystallography Open Database

Information card for entry 2242056

2242055 << 2242056 >> 2242057

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Coordinates	2242056.cif
Structure factors	2242056.hkl
Original IUCr paper	HTML

Structure parameters

Chemical name	Dimethyl 2-((2<i>Z</i>,5<i>Z</i>)-5-(2-methoxy-2-oxoethylidene)-2-{(<i>E</i>)-[2-methyl-5-(prop-1-en-2-yl)cyclohex-2-enylidene]hydrazinylidene}-4-oxothiazolidin-3-yl)fumarate
Formula	C22 H25 N3 O7 S
Calculated formula	C22 H25 N3 O7 S
Title of publication	Crystal structure of dimethyl 2-((2<i>Z</i>,5<i>Z</i>)-5-(2-methoxy-2-oxoethylidene)-2-{(<i>E</i>)-[2-methyl-5-(prop-1-en-2-yl)cyclohex-2-enylidene]hydrazinylidene}-4-oxothiazolidin-3-yl)fumarate
Authors of publication	N'ait Ousidi, Abdellah; Ait Itto, My Youssef; Auhmani, Aziz; Riahi, Abdelkhalek; Auhmani, Abdelwahed; Daran, Jean-Claude
Journal of publication	Acta Crystallographica Section E
Year of publication	2017
Journal volume	73
Journal issue	2
Pages of publication	296 - 299
a	8.2468 ± 0.0003 Å
b	9.8783 ± 0.0004 Å
c	15.1039 ± 0.0006 Å
α	96.144 ± 0.002°
β	105.172 ± 0.002°
γ	95.75 ± 0.002°
Cell volume	1170.14 ± 0.08 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0657
Residual factor for significantly intense reflections	0.0551
Weighted residual factors for significantly intense reflections	0.1193
Weighted residual factors for all reflections included in the refinement	0.1233
Goodness-of-fit parameter for all reflections included in the refinement	1.223
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

Version history

Revision	Date	Message	Files
193930 (current)	2017-03-05	cif/ hkl/ Adding structures of 2242056 via cif-deposit CGI script.	2242056.cif 2242056.hkl