Crystallography Open Database

Information card for entry 4324769

Preview

Coordinates	4324769.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H98 Cd14.5 O65
Calculated formula	C60 H98 Cd14.5 O65
Title of publication	Family of Cadmium Acetate Coordination Networks With Structurally Diverse [Cd4(OAc)9(μ3-OH)]2- Secondary Building Units
Authors of publication	Susan M. Vickers; Peter D. Frischmann; Mark J. MacLachlan
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	2957 - 2965
a	19.095 ± 0.001 Å
b	19.095 ± 0.001 Å
c	50.58 ± 0.002 Å
α	90 ± 0°
β	90 ± 0°
γ	120 ± 0°
Cell volume	15971.6 ± 1.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.045
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.0905
Weighted residual factors for all reflections included in the refinement	0.0977
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
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.	4324769.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4324769.cif
43220	2012-03-14	../uploads/cif-deposit/cod/cif Adding structures of 4324769 via cif-deposit CGI script.	4324769.cif