Crystallography Open Database

Information card for entry 7206955

7206954 << 7206955 >> 7206956

Preview

Coordinates	7206955.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H40 Fe3 N16 O8
Calculated formula	C64 H40 Fe3 N16 O8
Title of publication	Magnetic and luminescent properties of Cd(ii)- and Fe(ii)-anion radical frameworks: various networks or structures influenced by metal ion sizes or in situ forming mechanisms of anion radical ligand
Authors of publication	Yong, Guo-Ping; Li, Ying-Zhou; Zhang, Yi-Man; She, Wen-Long
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	4
Pages of publication	1439
a	16.172 ± 0.005 Å
b	16.172 ± 0.005 Å
c	19.553 ± 0.005 Å
α	90 ± 0.005°
β	90 ± 0.005°
γ	90 ± 0.005°
Cell volume	5114 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	133
Hermann-Mauguin space group symbol	P 42/n b c :2
Hall space group symbol	-P 4ac 2b
Residual factor for all reflections	0.1152
Residual factor for significantly intense reflections	0.0539
Weighted residual factors for significantly intense reflections	0.1418
Weighted residual factors for all reflections included in the refinement	0.1598
Goodness-of-fit parameter for all reflections included in the refinement	0.807
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
180400 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/69.	7206955.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206955.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206955.cif
32447	2012-02-09	../uploads/cif-deposit/cod/cif Adding structures of 7206954, 7206955, 7206956 via cif-deposit CGI script.	7206955.cif