Crystallography Open Database

Information card for entry 4339203

Preview

Coordinates	4339203.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H24.4 Fe Ge N6 O12.2
Calculated formula	C42 H24 Fe Ge N6 O12.2
Title of publication	Heterodimetallic germanium(IV) complex structures with transition metals.
Authors of publication	Shi, Fa-Nian; Cunha-Silva, Luís; Hardie, Michaele J.; Trindade, Tito; Paz, Filipe A Almeida; Rocha, João
Journal of publication	Inorganic chemistry
Year of publication	2007
Journal volume	46
Journal issue	16
Pages of publication	6502 - 6515
a	11.3137 ± 0.0005 Å
b	12.0536 ± 0.0005 Å
c	16.0827 ± 0.0011 Å
α	109.059 ± 0.004°
β	94.664 ± 0.004°
γ	111.536 ± 0.003°
Cell volume	1877.1 ± 0.19 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.086
Residual factor for significantly intense reflections	0.0418
Weighted residual factors for significantly intense reflections	0.0826
Weighted residual factors for all reflections included in the refinement	0.0981
Goodness-of-fit parameter for all reflections included in the refinement	1.002
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4339203.cif
117206	2014-06-14	cif/ Adding structures of 4339203 via cif-deposit CGI script.	4339203.cif