Crystallography Open Database

Information card for entry 1568680

Preview

Coordinates	1568680.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H24 N O P
Calculated formula	C26 H24 N O P
Title of publication	Enantioselective copper-catalyzed hydrophosphination of alkenyl isoquinolines.
Authors of publication	Yang, Qingjing; Zhou, Jian; Wang, Jun Joelle
Journal of publication	Chemical science
Year of publication	2023
Journal volume	14
Journal issue	16
Pages of publication	4413 - 4417
a	18.1535 ± 0.0009 Å
b	11.2621 ± 0.0005 Å
c	20.3773 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	4166.1 ± 0.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.064
Residual factor for significantly intense reflections	0.0414
Weighted residual factors for significantly intense reflections	0.0988
Weighted residual factors for all reflections included in the refinement	0.1101
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation probe	x-ray
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
283167 (current)	2023-05-05	cif/ Updating files of 1568680 Original log message: Adding full bibliography for 1568680.cif.	1568680.cif
281959	2023-03-22	cif/ Adding structures of 1568680 via cif-deposit CGI script.	1568680.cif