Crystallography Open Database

Information card for entry 4114355

Preview

Coordinates	4114355.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	(K-18C6)6[Ge9=Ge9=Ge9].2en
Formula	C75 H158 Ge27 K6 N4 O36
Calculated formula	C75 H157.99 Ge27 K6 N4 O36
Title of publication	Derivatization of Deltahedral Zintl Ions by Nucleophilic Addition: [Ph-Ge9-SbPh2]2-and [Ph2Sb-Ge9-Ge9-SbPh2]4-
Authors of publication	Angel Ugrinov; Slavi C. Sevov
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	14059 - 14064
a	15.187 ± 0.003 Å
b	37.638 ± 0.008 Å
c	23.04 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	13170 ± 5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	36
Hermann-Mauguin space group symbol	C m c 21
Hall space group symbol	C 2c -2
Residual factor for all reflections	0.1782
Residual factor for significantly intense reflections	0.1184
Weighted residual factors for significantly intense reflections	0.2735
Weighted residual factors for all reflections included in the refinement	0.2939
Goodness-of-fit parameter for all reflections included in the refinement	1.097
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
178914 (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 4/11/43.	4114355.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4114355.cif
67660	2012-10-02	cif/ Adding structures of 4114355 via cif-deposit CGI script.	4114355.cif