Crystallography Open Database

Information card for entry 7247428

Preview

Coordinates	7247428.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H19 N O3
Calculated formula	C18 H19 N O3
SMILES	O=C1CC(Cc2n(c(=O)cc(O)c12)Cc1ccccc1)(C)C
Title of publication	BiCl3-catalyzed green synthesis of 4-hydroxy-2-quinolone analogues under microwave irradiation
Authors of publication	Bouone, Yousra Ouafa; Bouzina, Abdeslem; Sayad, Rayene; Djemel, Abdelhak; Benaceur, Farouk; Zoukel, Abdelhalim; Ibrahim-Ouali, Malika; Aouf, Nour-Eddine; Bouchareb, Fouzia
Journal of publication	RSC Advances
Year of publication	2023
Journal volume	13
Journal issue	40
Pages of publication	28030 - 28041
a	6.437 ± 0.0003 Å
b	10.9513 ± 0.0004 Å
c	11.34 ± 0.0006 Å
α	102.588 ± 0.004°
β	102.906 ± 0.004°
γ	91.799 ± 0.003°
Cell volume	757.77 ± 0.06 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 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	0.0799
Residual factor for significantly intense reflections	0.0552
Weighted residual factors for significantly intense reflections	0.1414
Weighted residual factors for all reflections included in the refinement	0.1579
Goodness-of-fit parameter for all reflections included in the refinement	1.043
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
286464 (current)	2023-09-22	cif/ Adding structures of 7247428 via cif-deposit CGI script.	7247428.cif