Crystallography Open Database

Information card for entry 4327746

Preview

Coordinates	4327746.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[C4mim][HgCl3]
Chemical name	1-butyl-3-methylimidazolium trixchloridomercurate(II)
Formula	C8 H15 Cl3 Hg N2
Calculated formula	C8 H15 Cl3 Hg N2
Title of publication	Mercuric Ionic Liquids: [Cnmim][HgX3], Where n = 3, 4 and X = Cl, Br
Authors of publication	Bert Mallick; Andreas Metlen; Mark Nieuwenhuyzen; Robin D. Rogers; Anja-Verena Mudring
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	193 - 200
a	17.318 ± 0.003 Å
b	10.741 ± 0.0015 Å
c	7.4706 ± 0.0013 Å
α	90°
β	105.59 ± 0.013°
γ	90°
Cell volume	1338.5 ± 0.4 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 ± 2 K
Number of distinct elements	5
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0404
Residual factor for significantly intense reflections	0.0347
Weighted residual factors for significantly intense reflections	0.0885
Weighted residual factors for all reflections included in the refinement	0.09
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
179380 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/77.	4327746.cif
76668	2013-03-21	cif/ Adding structures of 4327746 via cif-deposit CGI script.	4327746.cif