Crystallography Open Database

Information card for entry 4105366

Preview

Coordinates	4105366.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C107 H94 Ag2 Au6 B4 Cl8 F16 N6 O P6
Calculated formula	C107 H94 Ag2 Au6 B4 Cl8 F16 N6 O P6
Title of publication	Intensely Luminescent Gold(I)-Silver(I) Cluster with Hypercoordinated Carbon
Authors of publication	Jian-Hua Jia; Quan-Ming Wang
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	16634 - 16635
a	15.5515 ± 0.0008 Å
b	27.1485 ± 0.0009 Å
c	16.1075 ± 0.0007 Å
α	90°
β	114.276 ± 0.005°
γ	90°
Cell volume	6199.2 ± 0.5 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	10
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1156
Residual factor for significantly intense reflections	0.051
Weighted residual factors for significantly intense reflections	0.1066
Weighted residual factors for all reflections included in the refinement	0.1148
Goodness-of-fit parameter for all reflections included in the refinement	0.901
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
188980 (current)	2016-12-06	cif/ (antanas@kurmis) Marking attached hydrogen atoms.	4105366.cif
178799	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/53.	4105366.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4105366.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4105366.cif
30561	2011-11-13	../uploads/cif-deposit/cod/cif Adding structures of 4105366 via cif-deposit CGI script.	4105366.cif