Crystallography Open Database

Information card for entry 4034535

Preview

Coordinates	4034535.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H24 F3 N3 O3
Calculated formula	C28 H24 F3 N3 O3
Title of publication	Pyrrolo-imidazo[1,2-<i>a</i>]pyridine Scaffolds through a Sequential Coupling of <i>N</i>-Tosylhydrazones with Imidazopyridines and Reductive Cadogan Annulation, Synthetic Scope, and Application.
Authors of publication	Zhang, Kena; El Bouakher, Abderrahman; Levaique, Helene; Bignon, Jerome; Retailleau, Pascal; Alami, Mouad; Hamze, Abdallah
Journal of publication	The Journal of organic chemistry
Year of publication	2019
Journal volume	84
Journal issue	21
Pages of publication	13807 - 13823
a	15.119 ± 0.015 Å
b	6.98 ± 0.005 Å
c	23.971 ± 0.015 Å
α	90°
β	98.71 ± 0.03°
γ	90°
Cell volume	2501 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1456
Residual factor for significantly intense reflections	0.0792
Weighted residual factors for significantly intense reflections	0.2168
Weighted residual factors for all reflections included in the refinement	0.2618
Goodness-of-fit parameter for all reflections included in the refinement	0.924
Diffraction radiation wavelength	1.54187 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
223034 (current)	2019-11-04	cif/ Adding structures of 4034535 via cif-deposit CGI script.	4034535.cif