Crystallography Open Database

Information card for entry 4070650

Preview

Coordinates	4070650.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H46 Au2 Cl4 N4 P2
Calculated formula	C54 H46 Au2 Cl4 N4 P2
Title of publication	Synthesis of Luminescent Alkynyl Gold Metalaligands Containing 2,2′-Bipyridine-5-yl and 2,2′:6′,2′′-Terpyridine-4-yl Donor Groups
Authors of publication	Vicente, José; Gil-Rubio, Juan; Barquero, Natalia; Jones, Peter G.; Bautista, Delia
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	4
Pages of publication	646
a	15.8653 ± 0.0011 Å
b	14.342 ± 0.0008 Å
c	22.9292 ± 0.0014 Å
α	90°
β	104.006 ± 0.004°
γ	90°
Cell volume	5062.2 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
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	0.0787
Residual factor for significantly intense reflections	0.0369
Weighted residual factors for significantly intense reflections	0.0773
Weighted residual factors for all reflections included in the refinement	0.0961
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
178595 (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 4/07/06.	4070650.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4070650.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4070650.cif
42618	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4070650 via cif-deposit CGI script.	4070650.cif