Crystallography Open Database

Information card for entry 7125715

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Coordinates	7125715.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Amol
Formula	C22 H28 N2 O2
Calculated formula	C22 H28 N2 O2
Title of publication	para-Selective copper-catalyzed C(sp<sup>2</sup>)-H amidation/dimerization of anilides via a radical pathway.
Authors of publication	Viveki, Amol B.; Garad, Dnyaneshwar N.; Gonnade, Rajesh G.; Mhaske, Santosh B.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	10
Pages of publication	1565 - 1568
a	18.3781 ± 0.0007 Å
b	9.6218 ± 0.0004 Å
c	11.0075 ± 0.0004 Å
α	90°
β	101.862 ± 0.002°
γ	90°
Cell volume	1904.9 ± 0.13 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0715
Residual factor for significantly intense reflections	0.0473
Weighted residual factors for significantly intense reflections	0.0965
Weighted residual factors for all reflections included in the refinement	0.1065
Goodness-of-fit parameter for all reflections included in the refinement	1.018
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
248806 (current)	2020-03-05	cif/ Updating files of 7125715, 7125716 Original log message: Adding full bibliography for 7125715--7125716.cif.	7125715.cif
246448	2020-01-03	cif/ Adding structures of 7125715, 7125716 via cif-deposit CGI script.	7125715.cif