Crystallography Open Database

Information card for entry 7029720

Preview

Coordinates	7029720.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Chloro-8-quinolylmercury(II)
Formula	C9 H6 Cl Hg N
Calculated formula	C9 H6 Cl Hg N
SMILES	[Hg](Cl)c1c2ncccc2ccc1
Title of publication	Preparation of RHgCl via transmetalation of (8-quinolyl)SnMe3 and redistribution to R2Hg (R = 8-quinolyl): a highly distorted diorganomercury(ii) with 84 degree C-Hg-C angle.
Authors of publication	Tamang, Sem Raj; Son, Jung-Ho; Hoefelmeyer, James D
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	19
Pages of publication	7139 - 7145
a	10.133 ± 0.005 Å
b	4.048 ± 0.005 Å
c	21.799 ± 0.005 Å
α	90 ± 0.005°
β	91.253 ± 0.005°
γ	90 ± 0.005°
Cell volume	893.9 ± 1.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0295
Residual factor for significantly intense reflections	0.0255
Weighted residual factors for significantly intense reflections	0.0624
Weighted residual factors for all reflections included in the refinement	0.065
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
180003 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/97.	7029720.cif
111184	2014-04-21	cif/ Updating files of 7029720 Original log message: Adding full bibliography for ./tmp-cod-update-bibliographies-12899/cifs/7029720.cif.	7029720.cif
109537	2014-04-16	cif/ Adding structures of 7029717, 7029718, 7029719, 7029720 via cif-deposit CGI script.	7029720.cif