Crystallography Open Database

Information card for entry 4500286

Preview

Coordinates	4500286.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H11 Cd I N4 O3
Calculated formula	C13 H11 Cd I N4 O3
Title of publication	Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies
Authors of publication	Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K.
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	4
Pages of publication	1122
a	10.719 ± 0.007 Å
b	17.883 ± 0.005 Å
c	8.208 ± 0.003 Å
α	90°
β	105.072 ± 0.005°
γ	90°
Cell volume	1519.2 ± 1.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0522
Residual factor for significantly intense reflections	0.0357
Weighted residual factors for significantly intense reflections	0.0837
Weighted residual factors for all reflections included in the refinement	0.0966
Goodness-of-fit parameter for all reflections included in the refinement	1.071
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179533 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/02.	4500286.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4500286.cif
34434	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4500286, 4500287, 4500288, 4500289, 4500290, 4500291, 4500292, 4500293 via cif-deposit CGI script.	4500286.cif