Crystallography Open Database

Information card for entry 4501402

Preview

Coordinates	4501402.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H86 Eu2 Mo2 N28 O9
Calculated formula	C84 H86 Eu2 Mo2 N28 O9
Title of publication	Syntheses, Structures, and Magnetic Properties of Five Novel Octacyanometallate-Based Lanthanide Complexes with Helical Chains
Authors of publication	Qian, Su-Yan; Zhou, Hu; Yuan, Ai-Hua; Song, You
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	12
Pages of publication	5676
a	37.021 ± 0.002 Å
b	37.021 ± 0.002 Å
c	15.8242 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	21688 ± 3 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	6
Space group number	142
Hermann-Mauguin space group symbol	I 41/a c d :2
Hall space group symbol	-I 4bd 2c
Residual factor for all reflections	0.0532
Residual factor for significantly intense reflections	0.04
Weighted residual factors for significantly intense reflections	0.1149
Weighted residual factors for all reflections included in the refinement	0.1207
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4501402.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4501402.cif
34888	2012-02-26	../uploads/cif-deposit/cod/cif Adding structures of 4501402 via cif-deposit CGI script.	4501402.cif