Crystallography Open Database

Information card for entry 1567275

Preview

Coordinates	1567275.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H17 F2 N O
Calculated formula	C17 H17 F2 N O
Title of publication	A concise method for cyclic gem-difluoroacyl scaffolds via visible-light-mediated redox-neutral cascade radical cyclization of alkenes
Authors of publication	Liu, Zhen; Wei, Yin; Shi, Min
Journal of publication	Catalysis Science & Technology
Year of publication	2022
Journal volume	12
Journal issue	17
Pages of publication	5325 - 5331
a	11.9237 ± 0.0004 Å
b	10.5309 ± 0.0004 Å
c	12.4165 ± 0.0003 Å
α	90°
β	114.482 ± 0.001°
γ	90°
Cell volume	1418.93 ± 0.08 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0577
Residual factor for significantly intense reflections	0.0427
Weighted residual factors for significantly intense reflections	0.1043
Weighted residual factors for all reflections included in the refinement	0.1166
Goodness-of-fit parameter for all reflections included in the refinement	1.054
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
277648 (current)	2022-09-06	cif/ Updating files of 1567274, 1567275 Original log message: Adding full bibliography for 1567274--1567275.cif.	1567275.cif
276784	2022-07-23	cif/ Adding structures of 1567274, 1567275 via cif-deposit CGI script.	1567275.cif