Crystallography Open Database

Information card for entry 7111488

Preview

Coordinates	7111488.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C96 H216 Ag16 P8 Si8
Calculated formula	C96 H220 Ag16 P8 Si8
Title of publication	Synthesis and crystal structure of [tBu3SiPAg2]8: A novel Ag16-cluster featuring a remarkable symmetrical structure
Authors of publication	Lerner, Hans-Wolfram; Margraf, Günter; Bats, Jan W.; Wagner, Matthias
Journal of publication	Chemical Communications
Year of publication	2005
Journal issue	36
Pages of publication	4545 - 4547
a	22.826 ± 0.002 Å
b	22.826 ± 0.002 Å
c	14.8258 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	7724.6 ± 1.3 Å³
Cell temperature	162 ± 2 K
Ambient diffraction temperature	162 ± 2 K
Number of distinct elements	5
Space group number	129
Hermann-Mauguin space group symbol	P 4/n m m :2
Hall space group symbol	-P 4a 2a
Residual factor for all reflections	0.1067
Residual factor for significantly intense reflections	0.0562
Weighted residual factors for significantly intense reflections	0.1466
Weighted residual factors for all reflections included in the refinement	0.1586
Goodness-of-fit parameter for all reflections included in the refinement	1.119
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
180228 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/14.	7111488.cif
96540	2014-01-29	cif/ Adding structures of 7111488 via cif-deposit CGI script.	7111488.cif