Crystallography Open Database

Information card for entry 4086453

Preview

Coordinates	4086453.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H46 Ge2 Li2 N4
Calculated formula	C32 H46 Ge2 Li2 N4
SMILES	[Ge]123[c]45c6ccc[c]74[CH]4=[N]2(C(C)(C)C)[Li]23574[Ge]34[c]57[Li]8913([N](=C6)C(C)(C)C)[c]7([CH]8=[N]49C(C)(C)C)cccc5C=[N]2C(C)(C)C
Title of publication	Synthesis of a Germylidenide Anion from the C‒C Bond Activation of a Bis(germylene)
Authors of publication	Seow, Celestine; Xi, Hong-Wei; Li, Yongxin; So, Cheuk-Wai
Journal of publication	Organometallics
Year of publication	2016
Journal volume	35
Journal issue	8
Pages of publication	1060
a	15.099 ± 0.004 Å
b	10.77 ± 0.003 Å
c	20.223 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	3288.6 ± 1.5 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	5
Space group number	54
Hermann-Mauguin space group symbol	P c c a
Hall space group symbol	-P 2a 2ac
Residual factor for all reflections	0.1222
Residual factor for significantly intense reflections	0.0728
Weighted residual factors for significantly intense reflections	0.1523
Weighted residual factors for all reflections included in the refinement	0.1724
Goodness-of-fit parameter for all reflections included in the refinement	1.09
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
182519 (current)	2016-05-04	cif/ Updating files of 4086452, 4086453, 4086454 Original log message: Adding full bibliography for 4086452--4086454.cif.	4086453.cif
181968	2016-04-08	cif/ Adding structures of 4086452, 4086453, 4086454 via cif-deposit CGI script.	4086453.cif