Crystallography Open Database

Information card for entry 7134166

Preview

Coordinates	7134166.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H20 N2 O
Calculated formula	C24 H20 N2 O
Title of publication	Copper catalyzed C(sp<sup>3</sup>)-H/C(sp<sup>3</sup>)-H cross-coupling of arylacetic acid equivalents with methylarenes <i>via</i> α-carbonyl radicals.
Authors of publication	Singh, Anupam Kumar; Rahaman, Ajijur; Patel, Upendra Kumar Brijmohan; Patel, Tulsi R.; Bhai, Surjit; Ganguly, Bishwajit; Bhadra, Sukalyan
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
Journal volume	61
Journal issue	14
Pages of publication	2941 - 2944
a	9.751 ± 0.0016 Å
b	19.705 ± 0.003 Å
c	9.8592 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	1894.4 ± 0.5 Å³
Cell temperature	278 K
Ambient diffraction temperature	278 K
Number of distinct elements	4
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.1637
Residual factor for significantly intense reflections	0.0539
Weighted residual factors for significantly intense reflections	0.1305
Weighted residual factors for all reflections included in the refinement	0.2066
Goodness-of-fit parameter for all reflections included in the refinement	1.111
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
298042 (current)	2025-03-04	cif/ Updating files of 7134166 Original log message: Adding full bibliography for 7134166.cif.	7134166.cif
297304	2025-01-14	cif/ Adding structures of 7134166 via cif-deposit CGI script.	7134166.cif