Crystallography Open Database

Information card for entry 4332645

Preview

Coordinates	4332645.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C154 H482 Cl20 Cu49 N26 O313 Sm12
Calculated formula	C154 H300 Cl20 Cu49 N26 O313 Sm12
Title of publication	Syntheses, Structures, and Properties of High-Nuclear 3d−4f Clusters with Amino Acid as Ligand: {Gd6Cu24}, {Tb6Cu26}, and {(Ln6Cu24)2Cu} (Ln= Sm, Gd)
Authors of publication	Zhang, Jian-Jun; Hu, Sheng-Min; Xiang, Sheng-Chang; Sheng, Tianlu; Wu, Xin-Tao; Li, Ya-Min
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	18
Pages of publication	7173 - 7181
a	30.1194 ± 0.001 Å
b	27.7611 ± 0.001 Å
c	29.2933 ± 0.001 Å
α	90°
β	93.434 ± 0.001°
γ	90°
Cell volume	24449.5 ± 1.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for significantly intense reflections	0.0869
Weighted residual factors for significantly intense reflections	0.2169
Weighted residual factors for all reflections included in the refinement	0.3228
Goodness-of-fit parameter for significantly intense reflections	1.141
Goodness-of-fit parameter for all reflections included in the refinement	1.163
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
179429 (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 4/33/26.	4332645.cif
98451	2014-01-30	cif/ Adding structures of 4332645 via cif-deposit CGI script.	4332645.cif