Crystallography Open Database

Information card for entry 2023479

2023478 << 2023479 >> 2023480

Preview

Coordinates	2023479.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	2-[4-(2-Methylpropyl)phenyl]-<i>N</i>'-[(1<i>Z</i>)-1-(thiophen-2-yl)ethylidene]propanehydrazide
Formula	C19 H24 N2 O S
Calculated formula	C19 H24 N2 O S
Title of publication	Crystal structure, Hirshfeld surface analysis and DFT studies of 2-[4-(2-methyl-prop-yl)phen-yl]-<i>N</i>'-[(1<i>Z</i>)-1-(thio-phen-2-yl)ethyl-idene]propane-hydrazide.
Authors of publication	Jayadevan, Sarayu; Sujith, K. V.; Biju, A. R.
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2025
Journal volume	81
Journal issue	Pt 5
Pages of publication	417 - 419
a	7.9057 ± 0.0003 Å
b	10.1929 ± 0.0003 Å
c	12.2794 ± 0.0003 Å
α	83.238 ± 0.001°
β	89.201 ± 0.001°
γ	71.122 ± 0.001°
Cell volume	929.45 ± 0.05 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0456
Residual factor for significantly intense reflections	0.0409
Weighted residual factors for significantly intense reflections	0.1172
Weighted residual factors for all reflections included in the refinement	0.1229
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation probe	x-ray
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
299931 (current)	2025-06-03	cif/ Updating files of 2023479 Original log message: Adding full bibliography for 2023479.cif.	2023479.cif
299398	2025-04-25	cif/ Adding structures of 2023479 via cif-deposit CGI script.	2023479.cif