Crystallography Open Database

Information card for entry 8000264

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Coordinates	8000264.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	N-Benzyl-3,7-dimethylimidazo[1,2-a]pyridine-2-carboxamide
Formula	C17 H17 N3 O
Calculated formula	C17 H17 N3 O
Title of publication	Scaffold-switching: An exploration of 5,6-fused bicyclic heteroaromatics systems to afford antituberculosis activity akin to the imidazo[1,2-a]pyridine-3-carboxylates
Authors of publication	Garrett C. Moraski; Allen G. Oliver; Lowell D. Markley; Sanghyun Cho; Scott G. Franzblau; Marvin J. Miller
Journal of publication	Bioorganic & Medicinal Chemistry Letters
Year of publication	2014
Journal volume	24
Pages of publication	3493 - 3498
a	7.9379 ± 0.0003 Å
b	19.6844 ± 0.0009 Å
c	9.5568 ± 0.0004 Å
α	90°
β	100.934 ± 0.002°
γ	90°
Cell volume	1466.17 ± 0.11 Å³
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0461
Residual factor for significantly intense reflections	0.0372
Weighted residual factors for significantly intense reflections	0.0922
Weighted residual factors for all reflections included in the refinement	0.0978
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
204927 (current)	2018-01-08	cif/ Adding structures of 8000264 via cif-deposit CGI script.	8000264.cif