Crystallography Open Database

Information card for entry 4086851

Preview

Coordinates	4086851.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	8-quinolinium tetrachlorogallate(III); 7
Formula	C9 H8 Cl4 Ga N
Calculated formula	C9 H8 Cl4 Ga N
SMILES	[Ga](Cl)(Cl)([Cl-])Cl.c12c([nH+]ccc1)cccc2
Title of publication	Dehydrodechlorination of Methylene Chloride, Chloroform, and Chlorodiphenylmethane in the Presence of Ga/N Lewis Pairs
Authors of publication	Son, Jung-Ho; Tamang, Sem Raj; Fostvedt, Jade I.; Hoefelmeyer, James D.
Journal of publication	Organometallics
Year of publication	2017
Journal volume	36
Journal issue	2
Pages of publication	474
a	14.744 ± 0.011 Å
b	13.879 ± 0.011 Å
c	12.485 ± 0.01 Å
α	90°
β	98.629 ± 0.011°
γ	90°
Cell volume	2526 ± 3 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	0.032
Residual factor for significantly intense reflections	0.0241
Weighted residual factors for significantly intense reflections	0.0545
Weighted residual factors for all reflections included in the refinement	0.0604
Goodness-of-fit parameter for all reflections included in the refinement	1.088
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
191367 (current)	2017-02-04	cif/ Updating files of 4086847, 4086848, 4086849, 4086850, 4086851, 4086852 Original log message: Adding full bibliography for 4086847--4086852.cif.	4086851.cif
189673	2017-01-01	cif/ Adding structures of 4086847, 4086848, 4086849, 4086850, 4086851, 4086852 via cif-deposit CGI script.	4086851.cif