Crystallography Open Database

Information card for entry 4114190

Preview

Coordinates	4114190.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	K2[Bert*Ge]2.4benzene
Formula	C96 H122 Ge2 K2
Calculated formula	C96.06 H116 Ge2 K2
Title of publication	Germanium and Tin Analogues of Alkynes and Their Reduction Products
Authors of publication	Lihung Pu; Andrew D. Phillips; Anne F. Richards; Matthias Stender; Richard S. Simons; Marilyn M. Olmstead; Philip P. Power
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	11626 - 11636
a	12.5633 ± 0.0013 Å
b	12.8465 ± 0.0012 Å
c	15.1597 ± 0.0011 Å
α	81.996 ± 0.007°
β	74.24 ± 0.007°
γ	65.17 ± 0.007°
Cell volume	2136.2 ± 0.4 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0421
Residual factor for significantly intense reflections	0.0376
Weighted residual factors for significantly intense reflections	0.0965
Weighted residual factors for all reflections included in the refinement	0.0994
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178912 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/41.	4114190.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4114190.cif
67473	2012-09-26	cif/ Adding structures of 4114190 via cif-deposit CGI script.	4114190.cif