Crystallography Open Database

Information card for entry 7018171

Preview

Coordinates	7018171.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C67 H52 Au3 B Cu F4 O6 P3
Calculated formula	C67 H52 Au3 B Cu F3.34 O6 P3
Title of publication	Luminescent heterometallic gold-copper alkynyl complexes stabilized by tridentate phosphine.
Authors of publication	Shakirova, Julia R.; Grachova, Elena V.; Gurzhiy, Vladislav V.; Koshevoy, Igor O.; Melnikov, Alexei S.; Sizova, Olga V.; Tunik, Sergey P.; Laguna, Antonio
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	10
Pages of publication	2941 - 2949
a	17.1354 ± 0.0007 Å
b	17.1354 ± 0.0007 Å
c	17.8646 ± 0.0008 Å
α	90°
β	90°
γ	120°
Cell volume	4542.7 ± 0.3 Å³
Cell temperature	210 ± 2 K
Ambient diffraction temperature	210 ± 2 K
Number of distinct elements	8
Space group number	146
Hermann-Mauguin space group symbol	R 3 :H
Hall space group symbol	R 3
Residual factor for all reflections	0.0515
Residual factor for significantly intense reflections	0.0273
Weighted residual factors for significantly intense reflections	0.0436
Weighted residual factors for all reflections included in the refinement	0.0469
Goodness-of-fit parameter for all reflections included in the refinement	0.791
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
179885 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/81.	7018171.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7018171.cif
37672	2012-03-04	../uploads/cif-deposit/cod/cif Adding structures of 7018169, 7018170, 7018171 via cif-deposit CGI script.	7018171.cif