Crystallography Open Database

Information card for entry 4334508

Preview

Coordinates	4334508.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C116 H200 Dy8 N16 O48
Calculated formula	C116 H200 Dy8 N16 O48
Title of publication	Octanuclear {Ln(III)8} (Ln = Gd, Tb, Dy, Ho) Macrocyclic Complexes in a Cyclooctadiene-like Conformation: Manifestation of Slow Relaxation of Magnetization in the Dy(III) Derivative
Authors of publication	Vadapalli Chandrasekhar; Prasenjit Bag; Enrique Colacio
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	4562 - 4570
a	18.228 ± 0.003 Å
b	18.228 ± 0.003 Å
c	44.831 ± 0.009 Å
α	90°
β	90°
γ	90°
Cell volume	14896 ± 5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.082
Residual factor for significantly intense reflections	0.0548
Weighted residual factors for significantly intense reflections	0.1439
Weighted residual factors for all reflections included in the refinement	0.1685
Goodness-of-fit parameter for all reflections included in the refinement	1.053
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
179448 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/45.	4334508.cif
100336	2014-02-04	cif/ Adding structures of 4334508 via cif-deposit CGI script.	4334508.cif