Crystallography Open Database

Information card for entry 4304367

Preview

Coordinates	4304367.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H20 Au4 Fe2 I5 N13
Calculated formula	C33 H20 Au4 Fe2 I5 N13
Title of publication	Spin-Crossover Behavior in Cyanide-bridged Iron(II)-Gold(I) Bimetallic 2D Hofmann-like Metal-Organic Frameworks
Authors of publication	Gloria Agustí; M. Carmen Muñoz; Ana B. Gaspar; José A. Real
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	2552 - 2561
a	23.519 ± 0.0005 Å
b	14.322 ± 0.0003 Å
c	15.306 ± 0.0003 Å
α	90°
β	106.822 ± 0.001°
γ	90°
Cell volume	4935.04 ± 0.18 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.1133
Residual factor for significantly intense reflections	0.0527
Weighted residual factors for significantly intense reflections	0.1065
Weighted residual factors for all reflections included in the refinement	0.1267
Goodness-of-fit parameter for all reflections included in the refinement	1
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
179081 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/43.	4304367.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4304367.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4304367.cif
1163	2010-05-11	cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition.	4304367.cif