Crystallography Open Database

Information card for entry 7029718

Preview

Coordinates	7029718.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Bis(quinolyl)mercury (II)(Bent)
Formula	C18 H12 Hg N2
Calculated formula	C18 H12 Hg N2
SMILES	c1nc2c(cccc2cc1)[Hg]c1cccc2cccnc12
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	14.1731 ± 0.0017 Å
b	6.2064 ± 0.0008 Å
c	10.469 ± 0.002 Å
α	90°
β	131.008 ± 0.001°
γ	90°
Cell volume	694.92 ± 0.18 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 0 K
Number of distinct elements	4
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.018
Residual factor for significantly intense reflections	0.018
Weighted residual factors for significantly intense reflections	0.0461
Weighted residual factors for all reflections included in the refinement	0.0461
Goodness-of-fit parameter for all reflections included in the refinement	1.087
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.	7029718.cif
111182	2014-04-21	cif/ Updating files of 7029718 Original log message: Adding full bibliography for ./tmp-cod-update-bibliographies-12899/cifs/7029718.cif.	7029718.cif
109537	2014-04-16	cif/ Adding structures of 7029717, 7029718, 7029719, 7029720 via cif-deposit CGI script.	7029718.cif