Crystallography Open Database

Information card for entry 4326364

Preview

Coordinates	4326364.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H60 Cl3 Cu3 F18 N10 P3
Calculated formula	C60 H60 Cl3 Cu3 F18 N10 P3
Title of publication	Immobilization, Trapping, and Anion Exchange of Perrhenate Ion Using Copper-Based Tripodal Complexes
Authors of publication	Rui Cao; Brian D. McCarthy; Stephen J. Lippard
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	9499 - 9507
a	23.6804 ± 0.0017 Å
b	23.6804 ± 0.0017 Å
c	30.596 ± 0.005 Å
α	90°
β	90°
γ	120°
Cell volume	14858 ± 3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0778
Residual factor for significantly intense reflections	0.0558
Weighted residual factors for significantly intense reflections	0.168
Weighted residual factors for all reflections included in the refinement	0.1792
Goodness-of-fit parameter for all reflections included in the refinement	1.086
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
179366 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/63.	4326364.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4326364.cif
48528	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 4326364 via cif-deposit CGI script.	4326364.cif