Crystallography Open Database

Information card for entry 7029717

Preview

Coordinates	7029717.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Bis(quinolyl)mercury (II)(Linear)
Formula	C18 H12 Hg N2
Calculated formula	C18 H12 Hg N2
SMILES	[Hg](c1c2ncccc2ccc1)c1c2c(cccn2)ccc1
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	4.7776 ± 0.0003 Å
b	11.4357 ± 0.0009 Å
c	25.3031 ± 0.0015 Å
α	90°
β	90.326 ± 0.001°
γ	90°
Cell volume	1382.42 ± 0.16 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
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	0.0387
Residual factor for significantly intense reflections	0.0246
Weighted residual factors for significantly intense reflections	0.0433
Weighted residual factors for all reflections included in the refinement	0.0472
Goodness-of-fit parameter for all reflections included in the refinement	1.016
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.	7029717.cif
111181	2014-04-21	cif/ Updating files of 7029717 Original log message: Adding full bibliography for ./tmp-cod-update-bibliographies-12899/cifs/7029717.cif.	7029717.cif
109537	2014-04-16	cif/ Adding structures of 7029717, 7029718, 7029719, 7029720 via cif-deposit CGI script.	7029717.cif