Crystallography Open Database

Information card for entry 7112947

Preview

Coordinates	7112947.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C59 H60 N2 O P2
Calculated formula	C59 H60 N2 O P2
Title of publication	Cationic zinc complexes: a new class of catalyst for living lactide polymerization at ambient temperature.
Authors of publication	Wheaton, Craig A.; Hayes, Paul G.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2010
Journal volume	46
Journal issue	44
Pages of publication	8404 - 8406
a	26.938 ± 0.003 Å
b	18.8282 ± 0.0018 Å
c	10.2745 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	5211.2 ± 0.9 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	0.0602
Residual factor for significantly intense reflections	0.0517
Weighted residual factors for significantly intense reflections	0.1195
Weighted residual factors for all reflections included in the refinement	0.1238
Goodness-of-fit parameter for all reflections included in the refinement	1.106
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
180243 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/29.	7112947.cif
112177	2014-04-30	cif/ Adding structures of 7112947, 7112948, 7112949 via cif-deposit CGI script.	7112947.cif