Crystallography Open Database

Information card for entry 7207419

7207418 << 7207419 >> 7207420

Preview

Coordinates	7207419.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H94 Cu6 N12 Nd4 O65
Calculated formula	C42 H94 Cu6 N12 Nd4 O65
Title of publication	Supramolecular assemblies involving metal‒organic ring interactions: heterometallic Cu(ii)‒Ln(iii) two-dimensional coordination polymers
Authors of publication	Konidaris, Konstantis F.; Morrison, Christine N.; Servetas, John G.; Haukka, Matti; Lan, Yanhua; Powell, Annie K.; Plakatouras, John C.; Kostakis, George E.
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	5
Pages of publication	1842
a	11.19 ± 0.002 Å
b	13.181 ± 0.003 Å
c	15.356 ± 0.003 Å
α	73.7 ± 0.03°
β	72.87 ± 0.03°
γ	79.78 ± 0.03°
Cell volume	2066.3 ± 0.8 Å³
Cell temperature	105 ± 2 K
Ambient diffraction temperature	105 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0518
Residual factor for significantly intense reflections	0.0345
Weighted residual factors for significantly intense reflections	0.0832
Weighted residual factors for all reflections included in the refinement	0.0902
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180405 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/74.	7207419.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7207419.cif
37639	2012-03-04	../uploads/cif-deposit/cod/cif Adding structures of 7207418, 7207419, 7207420 via cif-deposit CGI script.	7207419.cif