Crystallography Open Database

Information card for entry 4109939

Preview

Coordinates	4109939.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H39 N3 O2 Zn
Calculated formula	C30 H39 N3 O2 Zn
Title of publication	Alternating Copolymerization of Epoxides and Cyclic Anhydrides: An Improved Route to Aliphatic Polyesters
Authors of publication	Ryan C. Jeske; Angela M. DiCiccio; Geoffrey W. Coates
Journal of publication	Journal of the American Chemical Society
Year of publication	2007
Journal volume	129
Pages of publication	11330 - 11331
a	22.641 ± 0.003 Å
b	13.976 ± 0.003 Å
c	17.924 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5671.7 ± 1.7 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0596
Residual factor for significantly intense reflections	0.0489
Weighted residual factors for significantly intense reflections	0.1193
Weighted residual factors for all reflections included in the refinement	0.1247
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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
178845 (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 4/10/99.	4109939.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4109939.cif
58718	2012-05-30	cif/ Adding structures of 4109939 via cif-deposit CGI script.	4109939.cif