Crystallography Open Database

Information card for entry 2239044

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Structure parameters

Common name	1-(2,4-Dinitrophenyl)-2-[(<i>E</i>)-(3,4,5-trimethoxybenzylidene)]hydrazine
Chemical name	1-(2,4-Dinitrophenyl)-2-[(<i>E</i>)-(3,4,5-trimethoxybenzylidene)]hydrazine
Formula	C16 H16 N4 O7
Calculated formula	C16 H16 N4 O7
SMILES	O=N(=O)c1c(N/N=C/c2cc(OC)c(OC)c(OC)c2)ccc(N(=O)=O)c1
Title of publication	1-(2,4-Dinitrophenyl)-2-[(<i>E</i>)-(3,4,5-trimethoxybenzylidene)]hydrazine
Authors of publication	Chantrapromma, Suchada; Ruanwas, Pumsak; Boonnak, Nawong; Chidan Kumar, C. S.; Fun, Hoong-Kun
Journal of publication	Acta Crystallographica Section E
Year of publication	2014
Journal volume	70
Journal issue	2
Pages of publication	o188 - o189
a	7.4724 ± 0.0004 Å
b	14.3106 ± 0.0007 Å
c	16.1549 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	1727.52 ± 0.15 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0663
Residual factor for significantly intense reflections	0.0476
Weighted residual factors for significantly intense reflections	0.0989
Weighted residual factors for all reflections included in the refinement	0.1072
Goodness-of-fit parameter for all reflections included in the refinement	1.083
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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