Crystallography Open Database

Information card for entry 7002811

Preview

Coordinates	7002811.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H78 N4 O6 Zn2
Calculated formula	C50 H78 N4 O6 Zn2
Title of publication	Versatile catalytic systems based on complexes of zinc, magnesium and calcium supported by a bulky bis(morpholinomethyl)phenoxy ligand for the large-scale immortal ring-opening polymerisation of cyclic esters
Authors of publication	Poirier, Valentin; Roisnel, Thierry; Carpentier, Jean-François; Sarazin, Yann
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	44
Pages of publication	9820 - 9827
a	11.457 ± 0.0005 Å
b	12.3401 ± 0.0005 Å
c	13.3216 ± 0.0005 Å
α	112.077 ± 0.002°
β	107.626 ± 0.002°
γ	116.642 ± 0.002°
Cell volume	1282.8 ± 0.12 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	0.0305
Residual factor for significantly intense reflections	0.0267
Weighted residual factors for significantly intense reflections	0.0642
Weighted residual factors for all reflections included in the refinement	0.0664
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation probe	x-ray
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
179732 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/28.	7002811.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7002811.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7002811.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7002811.cif