Crystallography Open Database

Information card for entry 7224770

Preview

Coordinates	7224770.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	(EDBP)Y(CH2SiMe3)(THF)3
Formula	C92 H149 O10 Si2 Y2
Calculated formula	C92 H149 O10 Si2 Y2
Title of publication	Polymerization of conjugated dienes with homogeneous Ziegler-Natta catalytic system based on carbon-bridged bis(phenolate) yttrium alkyl complex
Authors of publication	Hong, Kan; Liang, Zhenhua; NI, Xufeng; Shen, Zhiquan
Journal of publication	RSC Adv.
Year of publication	2016
a	14.32342 ± 0.00016 Å
b	19.4258 ± 0.0002 Å
c	17.3277 ± 0.0002 Å
α	90°
β	103.239 ± 0.0012°
γ	90°
Cell volume	4693.2 ± 0.09 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0702
Residual factor for significantly intense reflections	0.0609
Weighted residual factors for significantly intense reflections	0.1575
Weighted residual factors for all reflections included in the refinement	0.1667
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
198632 (current)	2017-07-11	cod/ (melanie@ameba.ibt.lt) Correcting the '_exptl_absorpt_correction_type' data item 'multi-scan' enumeration values with the help of the cif_fix_values script from the cod-tools package revision 5455. The following command was used : cif_fix_values --fix-misspelled src/cod-tools/trunk/data/replacement-values/replacement_values.lst $i \| cif_filter --no-exclude-publication-details -h $i \| sponge $i A total of 524 files were changed.	7224770.cif
180653	2016-03-31	cif/ Adding structures of 7224770 via cif-deposit CGI script.	7224770.cif