Crystallography Open Database

Information card for entry 2311288

Preview

Coordinates	2311288.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Ethyl 2-(2,4,5-trimethoxyphenyl)quinoline-4-carboxylate
Formula	C21 H21 N O5
Calculated formula	C21 H21 N O5
Title of publication	Crystal structure of ethyl 2-(2,4,5-tri-meth-oxy-phen-yl)quinoline-4-carboxyl-ate.
Authors of publication	Shrungesh Kumar, T. O.; Naveen, S.; Kumara, M. N.; Mahadevan, K. M.; Lokanath, N. K.
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2015
Journal volume	71
Journal issue	Pt 7
Pages of publication	o514 - 5
a	8.3444 ± 0.0003 Å
b	9.3508 ± 0.0004 Å
c	12.2723 ± 0.0005 Å
α	104.079 ± 0.002°
β	97.282 ± 0.002°
γ	93.904 ± 0.002°
Cell volume	916.43 ± 0.06 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0446
Residual factor for significantly intense reflections	0.0387
Weighted residual factors for significantly intense reflections	0.1107
Weighted residual factors for all reflections included in the refinement	0.1171
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
245761 (current)	2019-12-25	cif/ Adding structures of 2311288 via cif-deposit CGI script.	2311288.cif