Crystallography Open Database

Information card for entry 4104082

Preview

Coordinates	4104082.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 I3 N6 Zn1.5
Calculated formula	C18 I3 N6 Zn1.25
Title of publication	Formation of a Thermally Stable, Porous Coordination Network via a Crystalline-to-Amorphous-to-Crystalline Phase Transition
Authors of publication	Kazuaki Ohara; Javier Martí-Rujas; Tsuyoshi Haneda; Masaki Kawano; Daisuke Hashizume; Fujio Izumi; Makoto Fujita
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	3860 - 3861
a	30.36 ± 0.001 Å
b	12.775 ± 0.0004 Å
c	13.5826 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	5268 ± 0.3 Å³
Ambient diffraction temperature	623 K
Number of distinct elements	4
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for significantly intense reflections	0.0159
Weighted residual factors for significantly intense reflections	0.0209
Method of determination	powder diffraction
Diffraction radiation wavelength	0.9948 Å
Diffraction radiation type	Synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178786 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/40.	4104082.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4104082.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4104082.cif
28589	2011-10-29	../uploads/cif-deposit/cod/cif Adding structures of 4104082 via cif-deposit CGI script.	4104082.cif