Crystallography Open Database

Information card for entry 7112084

7112083 << 7112084 >> 7112085

Preview

Coordinates	7112084.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16.67 H25.67 Ge N1.67
Calculated formula	C16.6667 H25.6667 Ge N1.66667
Title of publication	A functionalized Ge3-compound with a dual character of the central germanium atom
Authors of publication	Yan Li; Kartik Chandra Mondal; Jens Lubben; Hongping Zhu; Birger Dittrich; Indu Purushothaman; Pattiyil Parameswaran; Herbert W. Roesky
Journal of publication	Chem.Commun.
Year of publication	2014
Journal volume	50
Pages of publication	2986
a	13.32 ± 0.003 Å
b	17.51 ± 0.004 Å
c	21.95 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	5119.5 ± 1.9 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0412
Residual factor for significantly intense reflections	0.0406
Weighted residual factors for significantly intense reflections	0.1079
Weighted residual factors for all reflections included in the refinement	0.1084
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.6199 Å
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180234 (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 7/11/20.	7112084.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7112084.cif
104434	2014-03-11	cif/ Adding structures of 7112084 via cif-deposit CGI script.	7112084.cif