Crystallography Open Database

Information card for entry 4074724

Preview

Coordinates	4074724.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48.5 H18 Al Br F20 Zr
Calculated formula	C48.5 H18 Al Br F20 Zr
Title of publication	Diversity in Weakly Coordinating Anions. Mono- and Polynuclear Halo(perfluoroaryl)metalates as Cocatalysts for Stereospecific Olefin Polymerization: Synthesis, Structure, and Reactivity
Authors of publication	Chen, Ming-Chou; Roberts, John A. S.; Seyam, Afif M.; Li, Liting; Zuccaccia, Cristiano; Stahl, Nicholas G.; Marks, Tobin J.
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	11
Pages of publication	2833
a	14.145 ± 0.004 Å
b	14.57 ± 0.004 Å
c	15.542 ± 0.004 Å
α	111.423 ± 0.005°
β	100.32 ± 0.005°
γ	112.691 ± 0.005°
Cell volume	2552.9 ± 1.2 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 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	0.1687
Residual factor for significantly intense reflections	0.089
Weighted residual factors for significantly intense reflections	0.2469
Weighted residual factors for all reflections included in the refinement	0.3004
Goodness-of-fit parameter for all reflections included in the refinement	0.966
Diffraction radiation wavelength	0.71073 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.	4074724.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4074724.cif
48706	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4074714, 4074715, 4074716, 4074717, 4074718, 4074719, 4074720, 4074721, 4074722, 4074723, 4074724 via cif-deposit CGI script.	4074724.cif