Crystallography Open Database

Information card for entry 4083123

Preview

Coordinates	4083123.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C121 H110 Au6 F12 O7 P6
Calculated formula	C121 H110 Au6 F12 O7 P6
Title of publication	Luminescent Gold(I) Alkynyl Clusters Stabilized by Flexible Diphosphine Ligands
Authors of publication	Koshevoy, Igor O.; Chang, Yuh-Chia; Chen, Yi-An; Karttunen, Antti J.; Grachova, Elena V.; Tunik, Sergey P.; Jänis, Janne; Pakkanen, Tapani A.; Chou, Pi-Tai
Journal of publication	Organometallics
Year of publication	2014
Journal volume	33
Journal issue	9
Pages of publication	2363
a	33.5486 ± 0.001 Å
b	33.5486 ± 0.001 Å
c	20.9004 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	23523.6 ± 1.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	114
Hermann-Mauguin space group symbol	P -4 21 c
Hall space group symbol	P -4 2n
Residual factor for all reflections	0.0682
Residual factor for significantly intense reflections	0.0425
Weighted residual factors for significantly intense reflections	0.0948
Weighted residual factors for all reflections included in the refinement	0.1037
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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
178720 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/31.	4083123.cif
115900	2014-06-05	cif/ Updating files of 4083123, 4083124, 4083125, 4083126, 4083127, 4083128 Original log message: Adding full bibliography for 4083123--4083128.cif.	4083123.cif
112409	2014-05-01	cif/ Adding structures of 4083123, 4083124, 4083125, 4083126, 4083127, 4083128 via cif-deposit CGI script.	4083123.cif