Crystallography Open Database

Information card for entry 4102540

Preview

Coordinates	4102540.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H98 Ga2 N4 O4
Calculated formula	C88 H98 Ga2 N4 O4
Title of publication	Reversible Addition of Alkynes to Gallium Complex of Chelating Diamide Ligand
Authors of publication	Igor L. Fedushkin; Alexander S. Nikipelov; Konstantin A. Lyssenko
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	7874 - 7875
a	29.176 ± 0.004 Å
b	12.985 ± 0.002 Å
c	39.497 ± 0.006 Å
α	90°
β	100.678 ± 0.003°
γ	90°
Cell volume	14704 ± 4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1475
Residual factor for significantly intense reflections	0.0616
Weighted residual factors for significantly intense reflections	0.1061
Weighted residual factors for all reflections included in the refinement	0.1355
Goodness-of-fit parameter for all reflections included in the refinement	0.956
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178771 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/25.	4102540.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4102540.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4102540.cif
25421	2011-09-11	../uploads/cif-deposit/cod/cif Adding structures of 4102540 via cif-deposit CGI script.	4102540.cif