Crystallography Open Database

Information card for entry 4511854

Preview

Coordinates	4511854.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H16 Cu N2 O7
Calculated formula	C21 H16 Cu N2 O7
Title of publication	Structures, Magnetic Properties, and Photoluminescence of Dicarboxylate Coordination Polymers of Mn, Co, Ni, Cu HavingN-(4-Pyridylmethyl)-1,8-naphthalimide
Authors of publication	Nath, Jayanta K.; Mondal, Abhishake; Powell, Annie K.; Baruah, Jubaraj B.
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	9
Pages of publication	4735
a	15.1823 ± 0.0011 Å
b	7.801 ± 0.0006 Å
c	31.418 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	3721.1 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.089
Residual factor for significantly intense reflections	0.0406
Weighted residual factors for significantly intense reflections	0.0946
Weighted residual factors for all reflections included in the refinement	0.1389
Goodness-of-fit parameter for all reflections included in the refinement	1.001
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
179665 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/18.	4511854.cif
122858	2014-09-06	cif/ Updating files of 4511850, 4511851, 4511852, 4511853, 4511854, 4511855, 4511856 Original log message: Adding full bibliography for 4511850--4511856.cif.	4511854.cif
122479	2014-08-26	cif/ Adding structures of 4511854 via cif-deposit CGI script.	4511854.cif