Crystallography Open Database

Information card for entry 1567872

Preview

Coordinates	1567872.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H40 Cl2 N2 O3 Ru
Calculated formula	C33 H40 Cl2 N2 O3 Ru
Title of publication	Cyclic(alkyl)(amino)carbene ruthenium complexes for Z-stereoselective (asymmetric) olefin metathesis
Authors of publication	Morvan, Jennifer; Vermersch, François; Lorkowski, Jan; Talcik, Jakub; Vives, Thomas; Roisnel, Thierry; Crévisy, Christophe; Vanthuyne, Nicolas; Bertrand, Guy; Jazzar, Rodolphe; Mauduit, Marc
Journal of publication	Catalysis Science & Technology
Year of publication	2023
Journal volume	13
Journal issue	2
Pages of publication	381 - 388
a	17.3665 ± 0.0011 Å
b	11.5707 ± 0.0006 Å
c	17.4342 ± 0.0011 Å
α	90°
β	115.407 ± 0.002°
γ	90°
Cell volume	3164.4 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0335
Residual factor for significantly intense reflections	0.0275
Weighted residual factors for significantly intense reflections	0.0545
Weighted residual factors for all reflections included in the refinement	0.0567
Goodness-of-fit parameter for all reflections included in the refinement	1.042
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
281311 (current)	2023-03-04	cif/ Updating files of 1567867, 1567868, 1567869, 1567870, 1567871, 1567872 Original log message: Adding full bibliography for 1567867--1567872.cif.	1567872.cif
278861	2022-10-29	cif/ Adding structures of 1567867, 1567868, 1567869, 1567870, 1567871, 1567872 via cif-deposit CGI script.	1567872.cif