Crystallography Open Database

Information card for entry 4070801

Preview

Coordinates	4070801.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H37 Au Fe I N2 P
Calculated formula	C36 H37 Au Fe I N2 P
Title of publication	Diphenylphosphinoferrocene Gold(I) Acetylides: Synthesis of Heterotri- and Heterotetrametallic Transition Metal Complexes
Authors of publication	Packheiser, Rico; Jakob, Alexander; Ecorchard, Petra; Walfort, Bernhard; Lang, Heinrich
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	6
Pages of publication	1214
a	8.993 ± 0.002 Å
b	12.464 ± 0.003 Å
c	31.133 ± 0.008 Å
α	90°
β	90.645 ± 0.005°
γ	90°
Cell volume	3489.4 ± 1.5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0453
Residual factor for significantly intense reflections	0.0344
Weighted residual factors for significantly intense reflections	0.0861
Weighted residual factors for all reflections included in the refinement	0.093
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178597 (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 4/07/08.	4070801.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4070801.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4070801.cif
42712	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4070801 via cif-deposit CGI script.	4070801.cif