Crystallography Open Database

Information card for entry 4341071

Preview

Coordinates	4341071.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H52 N9 Nd O20
Calculated formula	C24 H48 N9 Nd O20
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	10.778 ± 0.003 Å
b	15.662 ± 0.005 Å
c	23.911 ± 0.008 Å
α	90°
β	99.735 ± 0.005°
γ	90°
Cell volume	3978 ± 2 Å³
Cell temperature	175 ± 2 K
Ambient diffraction temperature	175 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.044
Residual factor for significantly intense reflections	0.0345
Weighted residual factors for significantly intense reflections	0.0923
Weighted residual factors for all reflections included in the refinement	0.1001
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation wavelength	0.7749 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.	4341071.cif
126891	2014-11-12	cif/ Updating files of 4341069, 4341070, 4341071 Original log message: Adding full bibliography for 4341069--4341071.cif.	4341071.cif
123270	2014-09-07	cif/ Adding structures of 4341071 via cif-deposit CGI script.	4341071.cif