Crystallography Open Database

Information card for entry 7208537

7208536 << 7208537 >> 7208538

Preview

Coordinates	7208537.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H46 Fe N8 O8 S2
Calculated formula	C31 H24 Fe N8 O8 S2
Title of publication	Two novel high-dimensional iron(ii) coordination polymers modeled by semi-rigid tetrapyridines
Authors of publication	Yu, Fan; Li, Bao
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	18
Pages of publication	6049
a	8.9846 ± 0.0005 Å
b	22.9562 ± 0.0011 Å
c	24.0229 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	4954.8 ± 0.4 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	6
Space group number	66
Hermann-Mauguin space group symbol	C c c m
Hall space group symbol	-C 2 2c
Residual factor for all reflections	0.0668
Residual factor for significantly intense reflections	0.0459
Weighted residual factors for significantly intense reflections	0.1213
Weighted residual factors for all reflections included in the refinement	0.127
Goodness-of-fit parameter for all reflections included in the refinement	0.913
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
180416 (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 7/20/85.	7208537.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208537.cif
66485	2012-09-11	cif/ Adding structures of 7208537, 7208538 via cif-deposit CGI script.	7208537.cif