Crystallography Open Database

Information card for entry 2242774

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Structure parameters

Chemical name	<i>N</i>-<i>tert</i>-Butyl-2-(4-methoxyphenyl)-5-methylimidazo[1,2-<i>a</i>]pyridin-3-amine
Formula	C19 H23 N3 O
Calculated formula	C19 H23 N3 O
SMILES	O(c1ccc(c2nc3n(c(ccc3)C)c2NC(C)(C)C)cc1)C
Title of publication	Crystal structure and Hirshfeld surface analysis of two imidazo[1,2-<i>a</i>]pyridine derivatives: <i>N</i>-<i>tert</i>-butyl-2-(4-methoxyphenyl)-5-methylimidazo[1,2-<i>a</i>]pyridin-3-amine and <i>N</i>-<i>tert</i>-butyl-2-[4-(dimethylamino)phenyl]imidazo[1,2-<i>a</i>]pyridin-3-amine
Authors of publication	Dhanalakshmi, G.; Ramanjaneyulu, Mala; Thennarasu, Sathiah; Aravindhan, S.
Journal of publication	Acta Crystallographica Section E
Year of publication	2018
Journal volume	74
Journal issue	12
Pages of publication	1913 - 1918
a	9.2357 ± 0.0007 Å
b	15.6388 ± 0.0012 Å
c	11.984 ± 0.001 Å
α	90°
β	93.998 ± 0.003°
γ	90°
Cell volume	1726.7 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 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	0.0827
Residual factor for significantly intense reflections	0.0466
Weighted residual factors for significantly intense reflections	0.0994
Weighted residual factors for all reflections included in the refinement	0.119
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
212319 (current)	2018-12-04	cif/ hkl/ Adding structures of 2242774, 2242775 via cif-deposit CGI script.	2242774.cif 2242774.hkl