Crystallography Open Database

Information card for entry 1570430

Preview

Coordinates	1570430.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H23 F5 N2 O
Calculated formula	C30 H23 F5 N2 O
Title of publication	Photocatalytic (3 + 2) dipolar cycloadditions of aziridines driven by visible-light.
Authors of publication	Mazzarella, Daniele; Bortolato, Tommaso; Pelosi, Giorgio; Dell'Amico, Luca
Journal of publication	Chemical science
Year of publication	2023
Journal volume	15
Journal issue	1
Pages of publication	271 - 277
a	10.5292 ± 0.0002 Å
b	12.5977 ± 0.0002 Å
c	20.0573 ± 0.0004 Å
α	90°
β	103.635 ± 0.001°
γ	90°
Cell volume	2585.49 ± 0.08 Å³
Cell temperature	297 K
Ambient diffraction temperature	297 K
Number of distinct elements	5
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	0.1236
Residual factor for significantly intense reflections	0.0733
Weighted residual factors for significantly intense reflections	0.1918
Weighted residual factors for all reflections included in the refinement	0.2363
Goodness-of-fit parameter for all reflections included in the refinement	1.021
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
289395 (current)	2024-02-04	cif/ Updating files of 1570429, 1570430, 1570431 Original log message: Adding full bibliography for 1570429--1570431.cif.	1570430.cif
287864	2023-11-30	cif/ Adding structures of 1570429, 1570430, 1570431 via cif-deposit CGI script.	1570430.cif