Crystallography Open Database

Information card for entry 4071291

Preview

Coordinates	4071291.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H38 Fe O4 P4
Calculated formula	C16 H38 Fe O4 P4
Title of publication	Addition of CO2to Alkyl Iron Complexes, Fe(PP)2Me2
Authors of publication	Allen, Olivia R.; Dalgarno, Scott J.; Field, Leslie D.; Jensen, Paul; Turnbull, Anthony J.; Willis, Anthony C.
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	9
Pages of publication	2092
a	8.99 ± 0.001 Å
b	8.99 ± 0.001 Å
c	28.589 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2310.6 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.018
Residual factor for significantly intense reflections	0.0174
Weighted residual factors for significantly intense reflections	0.0485
Weighted residual factors for all reflections included in the refinement	0.0488
Goodness-of-fit parameter for all reflections included in the refinement	1.08
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4071291.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4071291.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071291.cif
43139	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4071290, 4071291, 4071292, 4071293, 4071294 via cif-deposit CGI script.	4071291.cif