Crystallography Open Database

Information card for entry 7239209

Preview

Coordinates	7239209.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	'4-(4-ethylphenyl)-2-phenyl-3-thioxo-2,3-dihydro-1H-pyrrolo[3,4-c] quinolin-1-one'
Formula	C25 H18 N2 O S
Calculated formula	C25 H18 N2 O S
Title of publication	One-pot two-component tandem multiple transformations in the synthesis of N,4-diaryl-2,3-dihydropyrrolo[3,4-c]quinolin-1,3-diones and their 3-thioxo-analogues under neat conditions
Authors of publication	Avula, Sreenivas; Koppireddi, Satish; Komsani, Jayaram Reddy; Nanubolu, Jagadeesh Babu; Yadla, Rambabu
Journal of publication	RSC Advances
Year of publication	2013
Journal volume	3
Journal issue	43
Pages of publication	20990
a	4.2876 ± 0.0005 Å
b	19.102 ± 0.002 Å
c	23.711 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	1942 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0912
Residual factor for significantly intense reflections	0.0867
Weighted residual factors for significantly intense reflections	0.1938
Weighted residual factors for all reflections included in the refinement	0.1965
Goodness-of-fit parameter for all reflections included in the refinement	1.315
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
244600 (current)	2019-11-28	cif/ Adding structures of 7239209 via cif-deposit CGI script.	7239209.cif