Crystallography Open Database

Information card for entry 7702856

Preview

Coordinates	7702856.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H144 Ga2 K2 N4 O18
Calculated formula	C88 H120 Ga2 K2 N4 O18
Title of publication	The reactivity of diazabutadienes toward low oxidation state Group 13 iodides and the synthesis of a new gallium(i) carbene analogue
Authors of publication	Baker, Robert J.; Farley, Robert D.; Jones, Cameron; Kloth, Marc; Murphy, Damien M.
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2002
Journal issue	20
Pages of publication	3844
a	20.844 ± 0.004 Å
b	26.08 ± 0.005 Å
c	17.719 ± 0.004 Å
α	90°
β	104.7 ± 0.03°
γ	90°
Cell volume	9317 ± 4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
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	0.1111
Residual factor for significantly intense reflections	0.069
Weighted residual factors for significantly intense reflections	0.1418
Weighted residual factors for all reflections included in the refinement	0.1565
Goodness-of-fit parameter for all reflections included in the refinement	1.084
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
244051 (current)	2019-11-28	cif/ Adding structures of 7702853, 7702854, 7702855, 7702856, 7702857, 7702858, 7702859 via cif-deposit CGI script.	7702856.cif