Crystallography Open Database

Information card for entry 4337534

Preview

Coordinates	4337534.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C91 H130 N2 O8 Yb2
Calculated formula	C91 H106 N2 O8 Yb2
Title of publication	New [ONOO]-type amine bis(phenolate) ytterbium(II) and -(III) complexes: synthesis, structure, and catalysis for highly heteroselective polymerization of rac-lactide.
Authors of publication	Yang, Sheng; Nie, Kun; Zhang, Yong; Xue, Mingqiang; Yao, Yingming; Shen, Qi
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	1
Pages of publication	105 - 115
a	16.6627 ± 0.0016 Å
b	20.8999 ± 0.0019 Å
c	25.771 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	8974.7 ± 1.4 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0995
Residual factor for significantly intense reflections	0.0787
Weighted residual factors for significantly intense reflections	0.1432
Weighted residual factors for all reflections included in the refinement	0.156
Goodness-of-fit parameter for all reflections included in the refinement	1.157
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179478 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/75.	4337534.cif
106457	2014-03-15	cif/ Adding structures of 4337532, 4337533, 4337534, 4337535 via cif-deposit CGI script.	4337534.cif