Crystallography Open Database

Information card for entry 4501477

Preview

Coordinates	4501477.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H28 Gd2 N4 O19
Calculated formula	C28 H28 Gd2 N4 O19
Title of publication	Synthesis Structures, and Properties of Functional 2-D Lanthanide Coordination Polymers [Ln2(dpa)2(C2O4)2(H2O)2]n(dpa = 2,2′-(2-methylbenzimidazolium-1,3-diyl)diacetate, C2O42−= oxalate, Ln = Nd, Eu, Gd, Tb)
Authors of publication	Wang, Xiu-Jian; Cen, Zhong-Min; Ni, Qing-Ling; Jiang, Xuan-Feng; Lian, Heng-Chi; Gui, Liu-Cheng; Zuo, Hua-Hong; Wang, Zuo-Yuan
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	7
Pages of publication	2960
a	10.5037 ± 0.0009 Å
b	13.3325 ± 0.0011 Å
c	13.6089 ± 0.0012 Å
α	61.936 ± 0.001°
β	85.446 ± 0.001°
γ	70.396 ± 0.001°
Cell volume	1577.2 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 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	0.0256
Residual factor for significantly intense reflections	0.022
Weighted residual factors for significantly intense reflections	0.0649
Weighted residual factors for all reflections included in the refinement	0.0669
Goodness-of-fit parameter for all reflections included in the refinement	1.106
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4501477.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4501477.cif
35942	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4501477 via cif-deposit CGI script.	4501477.cif