Crystallography Open Database

Information card for entry 4321914

4321913 << 4321914 >> 4321915

Preview

Coordinates	4321914.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C109 H218 Ge18 K6 N13 O36
Calculated formula	C109 H218 Ge18 K6 N13 O36
Title of publication	Conformation Isomerism of Nonagermanide Ions. Crystal Structures of Brown and Red [K-([2.2.2]crypt)]6Ge9Ge9.(ethylenediamine)x (x= 0.5, 1.5)
Authors of publication	Thomas F. Fässler; Uwe Schütz
Journal of publication	Inorganic Chemistry
Year of publication	1999
Journal volume	38
Pages of publication	1866 - 1870
a	14.397 ± 0.001 Å
b	19.765 ± 0.002 Å
c	28.898 ± 0.003 Å
α	87.485 ± 0.009°
β	79.168 ± 0.009°
γ	85.415 ± 0.008°
Cell volume	8047.3 ± 1.3 Å³
Cell temperature	213 ± 2 K
Ambient diffraction temperature	213 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1274
Residual factor for significantly intense reflections	0.0745
Weighted residual factors for significantly intense reflections	0.1715
Weighted residual factors for all reflections included in the refinement	0.2053
Goodness-of-fit parameter for all reflections included in the refinement	1.057
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
179322 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/19.	4321914.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4321914.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4321914.cif
19777	2011-05-25	../uploads/cif-deposit/cod/cif Adding structures of 4321914 via cif-deposit CGI script.	4321914.cif