Crystallography Open Database

Information card for entry 2242675

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Structure parameters

Common name	<i>N</i>-Isopropyl-<i>N</i>-(phenyl)phenylglyoxylamide
Chemical name	2-Oxo-<i>N</i>,2-diphenyl-<i>N</i>-(propan-2-yl)acetamide
Formula	C17 H17 N O2
Calculated formula	C17 H17 N O2
SMILES	O=C(c1ccccc1)C(=O)N(c1ccccc1)C(C)C
Title of publication	Crystal structure of <i>N</i>-isopropyl-<i>N</i>-(phenyl)phenylglyoxylamide
Authors of publication	Miyamoto, Hisakazu; Yamauchi, Genta; Ueno, Takuya; Uekusa, Hidehiro
Journal of publication	Acta Crystallographica Section E
Year of publication	2018
Journal volume	74
Journal issue	11
Pages of publication	1574 - 1576
a	5.8354 ± 0.0005 Å
b	16.5123 ± 0.0014 Å
c	15.133 ± 0.0012 Å
α	90°
β	93.837 ± 0.002°
γ	90°
Cell volume	1454.9 ± 0.2 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 2 K
Number of distinct elements	4
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	0.068
Residual factor for significantly intense reflections	0.0543
Weighted residual factors for significantly intense reflections	0.1349
Weighted residual factors for all reflections included in the refinement	0.1429
Goodness-of-fit parameter for all reflections included in the refinement	1.126
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
211461 (current)	2018-10-13	cif/ hkl/ Adding structures of 2242675 via cif-deposit CGI script.	2242675.cif 2242675.hkl