Crystallography Open Database

Information card for entry 4329133

Preview

Coordinates	4329133.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Cr-F-Nd Bipy square
Formula	C40 H32 Cr2 F4 N16 Nd2 O24
Calculated formula	C40 H32 Cr2 F4 N16 Nd2 O24
Title of publication	Fluoride Bridges as Structure-Directing Motifs in 3d-4f Cluster Chemistry
Authors of publication	Torben Birk; Kasper S. Pedersen; Christian Aa. Thuesen; Thomas Weyhermüller; Magnus Schau-Magnussen; Stergios Piligkos; Högni Weihe; Susanne Mossin; Marco Evangelisti; Jesper Bendix
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	5435 - 5443
a	12.2727 ± 0.0008 Å
b	15.3327 ± 0.0008 Å
c	15.7225 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	2958.6 ± 0.3 Å³
Cell temperature	122 ± 1 K
Ambient diffraction temperature	122 ± 2 K
Number of distinct elements	7
Space group number	23
Hermann-Mauguin space group symbol	I 2 2 2
Hall space group symbol	I 2 2
Residual factor for all reflections	0.088
Residual factor for significantly intense reflections	0.0827
Weighted residual factors for significantly intense reflections	0.2217
Weighted residual factors for all reflections included in the refinement	0.2269
Goodness-of-fit parameter for all reflections included in the refinement	1.102
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
179394 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/91.	4329133.cif
78173	2013-04-01	cif/ Adding structures of 4329133 via cif-deposit CGI script.	4329133.cif