Crystallography Open Database

Information card for entry 4104541

Preview

Coordinates	4104541.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C55 H76 N2 O W
Calculated formula	C55 H76 N2 O W
Title of publication	Z-Selective Olefin Metathesis Processes Catalyzed by a Molybdenum Hexaisopropylterphenoxide Monopyrrolide Complex
Authors of publication	Margaret M. Flook; Annie J. Jiang; Richard R. Schrock; Amir H. Hoveyda
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	7962 - 7963
a	8.702 ± 0.002 Å
b	12.33 ± 0.003 Å
c	23.758 ± 0.006 Å
α	92.188 ± 0.004°
β	91.229 ± 0.004°
γ	101.656 ± 0.004°
Cell volume	2493.6 ± 1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0822
Residual factor for significantly intense reflections	0.0672
Weighted residual factors for significantly intense reflections	0.1587
Weighted residual factors for all reflections included in the refinement	0.1684
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178791 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/45.	4104541.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4104541.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4104541.cif
29565	2011-11-03	../uploads/cif-deposit/cod/cif Adding structures of 4104541 via cif-deposit CGI script.	4104541.cif