Crystallography Open Database

Information card for entry 4517338

Preview

Coordinates	4517338.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Keinan162b (Ofer)
Formula	C53 H54 Cl2 N2 O3 P Ru
Calculated formula	C53 H54 Cl2 N2 O3 P Ru
Title of publication	Latent Ruthenium Benzylidene Phosphite Complexes for Visible-Light-Induced Olefin Metathesis
Authors of publication	Eivgi, Or; Vaisman, Anna; Nechmad, Noy B.; Baranov, Mark; Lemcoff, N. Gabriel
Journal of publication	ACS Catalysis
Year of publication	2020
Pages of publication	2033 - 2038
a	9.051 ± 0.006 Å
b	12.257 ± 0.005 Å
c	23.016 ± 0.004 Å
α	99.247 ± 0.003°
β	100.894 ± 0.002°
γ	94.83 ± 0.004°
Cell volume	2457 ± 2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1804
Residual factor for significantly intense reflections	0.0796
Weighted residual factors for significantly intense reflections	0.1629
Weighted residual factors for all reflections included in the refinement	0.2122
Goodness-of-fit parameter for all reflections included in the refinement	0.908
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
257052 (current)	2020-10-04	cif/ Updating files of 4517338, 4517339 Original log message: Adding full bibliography for 4517338--4517339.cif.	4517338.cif
247204	2020-01-25	cif/ Adding structures of 4517338 via cif-deposit CGI script.	4517338.cif