Crystallography Open Database

Information card for entry 7205215

7205214 << 7205215 >> 7205216

Preview

Coordinates	7205215.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 F8 Hg N2 O4
Calculated formula	C12 F8 Hg N2 O4
Title of publication	A supramolecular twist to the structures of bis(polyfluorophenyl)mercurials
Authors of publication	Deacon, Glen B.; Forsyth, Craig M.; Junk, Peter C.; Izgorodina, Ekaterina I.; Ness, Timothy J.; Meyer, Gerd; Pantenburg, Ingo
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	1
Pages of publication	88
a	12.7462 ± 0.0003 Å
b	8.5095 ± 0.0002 Å
c	13.1712 ± 0.0003 Å
α	90°
β	105.339 ± 0.001°
γ	90°
Cell volume	1377.71 ± 0.06 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0446
Residual factor for significantly intense reflections	0.0361
Weighted residual factors for significantly intense reflections	0.0874
Weighted residual factors for all reflections included in the refinement	0.0919
Goodness-of-fit parameter for all reflections included in the refinement	1.063
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
180383 (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 7/20/52.	7205215.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205215.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205215.cif
14577	2011-03-11	../uploads/cif-deposit/cod/cif Adding structures of 7205214, 7205215, 7205216 via cif-deposit CGI script.	7205215.cif