Crystallography Open Database

Information card for entry 2233010

Preview

Coordinates	2233010.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Poly[[hexaaqua(μ~2~-oxalato- κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^)bis(μ~3~-pyridine-2,4- dicarboxylato-κ^4^<i>N</i>,<i>O</i>^2^:<i>O</i>^2'^:<i>O</i>^4^) dilanthanum(III)] monohydrate]
Formula	C16 H20 La2 N2 O19
Calculated formula	C16 H20 La2 N2 O19
Title of publication	Poly[[hexaaqua(μ~2~-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^)bis(μ~3~-pyridine-2,4-dicarboxylato-κ^4^<i>N</i>,<i>O</i>^2^:<i>O</i>^2'^:<i>O</i>^4^)dilanthanum(III)] monohydrate]
Authors of publication	Shen, Fwu Ming; Lush, Shie Fu
Journal of publication	Acta Crystallographica Section E
Year of publication	2011
Journal volume	67
Journal issue	12
Pages of publication	m1731 - m1732
a	6.4614 ± 0.0008 Å
b	6.6844 ± 0.0008 Å
c	14.0796 ± 0.0017 Å
α	89.735 ± 0.002°
β	85.266 ± 0.002°
γ	73.135 ± 0.002°
Cell volume	579.85 ± 0.12 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0377
Residual factor for significantly intense reflections	0.0324
Weighted residual factors for significantly intense reflections	0.0903
Weighted residual factors for all reflections included in the refinement	0.0929
Goodness-of-fit parameter for all reflections included in the refinement	1.088
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
176798 (current)	2016-02-21	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23.	2233010.cif
120072	2014-07-11	Adding DOIs to range 2 structures.	2233010.cif
31903	2012-01-02	../uploads/cif-deposit/cod/cif Adding structures of 2233010 via cif-deposit CGI script.	2233010.cif