Crystallography Open Database

Information card for entry 4071680

Preview

Coordinates	4071680.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H64 Fe2 Ga O5 P3
Calculated formula	C50 H48 Fe2 Ga O5 P3
Title of publication	Reactions of a Gallium-Bridged Diiron Complex with Alkyl Lithium, HCl, and Phosphines
Authors of publication	Muraoka, Takako; Motohashi, Hideaki; Hirotsu, Masakazu; Ueno, Keiji
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	15
Pages of publication	3918
a	25.3048 ± 0.0011 Å
b	21.5508 ± 0.001 Å
c	18.0423 ± 0.0009 Å
α	90°
β	92.599 ± 0.002°
γ	90°
Cell volume	9829 ± 0.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.071
Residual factor for significantly intense reflections	0.0618
Weighted residual factors for significantly intense reflections	0.1729
Weighted residual factors for all reflections included in the refinement	0.2141
Goodness-of-fit parameter for all reflections included in the refinement	1.213
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
178605 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/16.	4071680.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4071680.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071680.cif
43977	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4071679, 4071680 via cif-deposit CGI script.	4071680.cif