Crystallography Open Database

Information card for entry 4081327

Preview

Coordinates	4081327.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H48 Mo N2 O
Calculated formula	C37 H48 Mo N2 O
Title of publication	Z-Selective Ring-Opening Metathesis Polymerization of 3-Substituted Cyclooctenes by Monoaryloxide Pyrrolide Imido Alkylidene (MAP) Catalysts of Molybdenum and Tungsten
Authors of publication	Jeong, Hyangsoo; Kozera, Daniel J.; Schrock, Richard R.; Smith, Stacey J.; Zhang, Jihua; Ren, Ning; Hillmyer, Marc A.
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	17
Pages of publication	4843
a	11.8579 ± 0.0005 Å
b	16.24 ± 0.0007 Å
c	18.1978 ± 0.0008 Å
α	90°
β	92.534 ± 0.001°
γ	90°
Cell volume	3501 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0357
Residual factor for significantly intense reflections	0.0293
Weighted residual factors for significantly intense reflections	0.0736
Weighted residual factors for all reflections included in the refinement	0.0773
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
178702 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/13.	4081327.cif
126004	2014-10-30	cod/ (saulius@kolibris) Adding full bibliographies to the recently deposited structures from RSS feeds.	4081327.cif
89202	2013-10-09	cif/ Adding structures of 4081327 via cif-deposit CGI script.	4081327.cif