Crystallography Open Database

Information card for entry 7206543

7206542 << 7206543 >> 7206544

Preview

Coordinates	7206543.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H27 Fe N6 O6
Calculated formula	C39 H27 Fe N6 O6
Title of publication	The novel metalloligand [Fe(bppd)3] (bppd = 1,3-bis(4-pyridyl)-1,3-propanedionate) for the crystal engineering of heterometallic coordination networks with different silver salts. Anionic control of the structures
Authors of publication	Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Visconti, Marco
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	19
Pages of publication	5891
a	35.923 ± 0.006 Å
b	20.557 ± 0.003 Å
c	16.968 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	12530 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.1312
Residual factor for significantly intense reflections	0.0989
Weighted residual factors for all reflections	0.2938
Weighted residual factors for all reflections included in the refinement	0.265
Goodness-of-fit parameter for all reflections	1.03
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
180396 (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 7/20/65.	7206543.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206543.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206543.cif
28010	2011-10-13	../uploads/cif-deposit/cod/cif Adding structures of 7206543, 7206544, 7206545, 7206546, 7206547, 7206548 via cif-deposit CGI script.	7206543.cif