Crystallography Open Database

Information card for entry 7215031

Preview

Coordinates	7215031.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H18 Fe3 N4 O18
Calculated formula	C20 H18 Fe3 N4 O18
Title of publication	A series of coordination polymers constructed from in situ amidation ligands: syntheses, structures and luminescent properties
Authors of publication	Yu, Xiao-Yang; Cui, Xiao-Bing; Yang, Jia-Jun; Zhang, Jian-Po; Luo, Yu-Hui; Zhang, Hong; Gao, Wei-Ping
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	14
Pages of publication	4719
a	6.4427 ± 0.0013 Å
b	9.5515 ± 0.0019 Å
c	10.224 ± 0.002 Å
α	107.45 ± 0.03°
β	91.15 ± 0.03°
γ	101.7 ± 0.03°
Cell volume	585.5 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.103
Residual factor for significantly intense reflections	0.0792
Weighted residual factors for significantly intense reflections	0.2211
Weighted residual factors for all reflections included in the refinement	0.2358
Goodness-of-fit parameter for all reflections included in the refinement	1.033
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
180481 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/50.	7215031.cif
111018	2014-04-20	cif/ Adding structures of 7215031, 7215032, 7215033, 7215034 via cif-deposit CGI script.	7215031.cif