Crystallography Open Database

Information card for entry 1508549

Preview

Coordinates	1508549.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H44 Cl5 N O Sn
Calculated formula	C20 H44 Cl5 N O Sn
SMILES	[Sn](Cl)(Cl)(Cl)(Cl)(Cl)[O]1CCCC1.[N+](CCCC)(CCCC)(CCCC)CCCC
Title of publication	Structure Effects of Lewis Acids on the Living Cationic Polymerization ofp-Methoxystyrene: Distinct Difference in Polymerization Behavior from Vinyl Ethers
Authors of publication	Kanazawa, Arihiro; Shibutani, Shota; Yoshinari, Nobuto; Konno, Takumi; Kanaoka, Shokyoku; Aoshima, Sadahito
Journal of publication	Macromolecules
Year of publication	2012
Journal volume	45
Journal issue	19
Pages of publication	7749
a	11.3265 ± 0.0006 Å
b	11.7429 ± 0.0005 Å
c	12.8716 ± 0.0006 Å
α	72.932 ± 0.005°
β	64.349 ± 0.005°
γ	86.317 ± 0.006°
Cell volume	1471.38 ± 0.15 Å³
Cell temperature	280 ± 2 K
Ambient diffraction temperature	280 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0671
Residual factor for significantly intense reflections	0.0503
Weighted residual factors for significantly intense reflections	0.1301
Weighted residual factors for all reflections included in the refinement	0.1384
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1508549.cif
91932	2013-12-28	cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs.	1508549.cif
72049	2013-01-21	cif/ Adding structures of 1508549, 1508550 via cif-deposit CGI script.	1508549.cif