Crystallography Open Database

Information card for entry 4341069

Preview

Coordinates	4341069.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H48 Cl3 N6 Nd O21
Calculated formula	C24 H48 Cl3 N6 Nd O20.97
Title of publication	Structural and thermodynamic study of the complexes of Nd(III) with N,N,N',N'-tetramethyl-3-oxa-glutaramide and the acid analogues.
Authors of publication	Tian, Guoxin; Teat, Simon J.; Rao, Linfeng
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	18
Pages of publication	9477 - 9485
a	19.591 ± 0.003 Å
b	13.366 ± 0.003 Å
c	15.526 ± 0.002 Å
α	90°
β	100.334 ± 0.006°
γ	90°
Cell volume	3999.6 ± 1.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0471
Residual factor for significantly intense reflections	0.0442
Weighted residual factors for significantly intense reflections	0.1175
Weighted residual factors for all reflections included in the refinement	0.1195
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	0.7758 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179513 (current)	2016-03-23	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/10.	4341069.cif
126891	2014-11-12	cif/ Updating files of 4341069, 4341070, 4341071 Original log message: Adding full bibliography for 4341069--4341071.cif.	4341069.cif
123267	2014-09-07	cif/ Adding structures of 4341069 via cif-deposit CGI script.	4341069.cif