Crystallography Open Database

Information card for entry 4331605

Preview

Coordinates	4331605.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	H144 I16 O82 Tb12
Calculated formula	I16 O82 Tb12
Title of publication	Cluster-Type Basic Lanthanide Iodides [M6(μ6-O)(μ3-OH)8(H2O)24]I8(H2O)8(M = Nd, Eu, Tb, Dy)
Authors of publication	Mudring, Anja-Verena; Timofte, Tudor; Babai, Arash
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	13
Pages of publication	5162 - 5166
a	12.9634 ± 0.0005 Å
b	14.8613 ± 0.0007 Å
c	14.9188 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	2874.2 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	58
Hermann-Mauguin space group symbol	P n n m
Hall space group symbol	-P 2 2n
Residual factor for all reflections	0.0571
Residual factor for significantly intense reflections	0.0395
Weighted residual factors for significantly intense reflections	0.0924
Weighted residual factors for all reflections included in the refinement	0.0984
Goodness-of-fit parameter for all reflections included in the refinement	1
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
210306 (current)	2018-09-01	cif/4/ Updating bibliography in entries 4331599, 4331601, 4331603, 4331605, 4343879, 4343880. Marking entries 4343879-4343880 as duplicates of entries 4331599, 4331605.	4331605.cif
189852	2017-01-05	cif/4/33/ (antanas@kurmis) Changing the capitalization of _atom_type_symbol data item values and updating the _chemical_formula_sum data item value in entry 4331605.	4331605.cif
179419	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 4/33/16.	4331605.cif
97739	2014-01-29	cif/ Adding structures of 4331605 via cif-deposit CGI script.	4331605.cif