Crystallography Open Database

Information card for entry 4337533

Preview

Coordinates	4337533.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38.5 H57 N3 O3 Yb
Calculated formula	C38.5 H53 N3 O3 Yb
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	13.552 ± 0.004 Å
b	17.092 ± 0.005 Å
c	17.402 ± 0.006 Å
α	90°
β	104.584 ± 0.007°
γ	90°
Cell volume	3901 ± 2 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0773
Residual factor for significantly intense reflections	0.0548
Weighted residual factors for significantly intense reflections	0.1531
Weighted residual factors for all reflections included in the refinement	0.2295
Goodness-of-fit parameter for all reflections included in the refinement	1.142
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4337533.cif
106457	2014-03-15	cif/ Adding structures of 4337532, 4337533, 4337534, 4337535 via cif-deposit CGI script.	4337533.cif