Crystallography Open Database

Information card for entry 7052900

Preview

Coordinates	7052900.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Catena-(bis(mu2-4,4-trimethylenedipyridine)) copper(ii) dinitrate 1,2-dichlorobenzene methanol solvate
Chemical name	Catena-(bis(mu2-4,4-trimethylenedipyridine)) copper(ii) dinitrate 1,2-dichlorobenzene methanol solvate
Formula	C33.75 H39 Cl2 Cu N6 O7.75
Calculated formula	C33.75 H39 Cl2 Cu N6 O7.75
Title of publication	Poly(methyl methacrylate) composites of copper-4,4′-trimethylenedipyridine
Authors of publication	Liu, Shisi; Ananthoji, Ramakanth; Han, Sungyub; Knudsen, Bernard; Li, Xiao; Wojtas, Lukasz; Massing, Justin; Gauthier, Carmen Valdez; Harmon, Julie P.
Journal of publication	New Journal of Chemistry
Year of publication	2012
Journal volume	36
Journal issue	7
Pages of publication	1449
a	10.369 ± 0.007 Å
b	12.645 ± 0.009 Å
c	14.307 ± 0.009 Å
α	102.839 ± 0.013°
β	92.253 ± 0.014°
γ	102.395 ± 0.011°
Cell volume	1779 ± 2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.1486
Residual factor for significantly intense reflections	0.0771
Weighted residual factors for significantly intense reflections	0.1639
Weighted residual factors for all reflections included in the refinement	0.193
Goodness-of-fit parameter for all reflections included in the refinement	1.013
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
180083 (current)	2016-03-26	cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/29.	7052900.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7052900.cif
62946	2012-07-09	cif/ Adding structures of 7052900 via cif-deposit CGI script.	7052900.cif