Crystallography Open Database

Information card for entry 7112103

Preview

Coordinates	7112103.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H22 Ge N2
Calculated formula	C18 H22 Ge N2
Title of publication	Unusual formation of a N-heterocyclic germylene via homolytic cleavage of a C-C bond
Authors of publication	Yan Li; Kartik Chandra Mondal; Peter Stollberg; Hongping Zhu; Herbert W. Roesky; Regine Herbst-Irmer; Dietmar Stalke; Heike Fliegl
Journal of publication	Chem.Commun.
Year of publication	2014
Journal volume	50
Pages of publication	3356
a	24.693 ± 0.003 Å
b	10.903 ± 0.002 Å
c	27.84 ± 0.003 Å
α	90°
β	114.96 ± 0.02°
γ	90°
Cell volume	6795 ± 2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
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	0.0442
Residual factor for significantly intense reflections	0.0343
Weighted residual factors for significantly intense reflections	0.0772
Weighted residual factors for all reflections included in the refinement	0.0809
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.56086 Å
Diffraction radiation type	AgKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180235 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/21.	7112103.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7112103.cif
105515	2014-03-12	cif/ Adding structures of 7112102, 7112103, 7112104, 7112105 via cif-deposit CGI script.	7112103.cif