Crystallography Open Database

Information card for entry 4119539

4119538 << 4119539 >> 4119540

Preview

Coordinates	4119539.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H90 Au4 B4 N24 O9 W4
Calculated formula	C72 H88 Au4 B4 N24 O9 W4
Title of publication	A Golden Ring: Molecular Gold Carbido Complexes
Authors of publication	Elliot S. Borren; Anthony F. Hill; Rong Shang; Manab Sharma; Anthony C. Willis
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	4942 - 4945
a	14.1428 ± 0.0004 Å
b	19.4442 ± 0.0004 Å
c	19.5444 ± 0.0003 Å
α	89.6316 ± 0.0013°
β	70.6096 ± 0.0013°
γ	85.402 ± 0.0012°
Cell volume	5052.3 ± 0.2 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0959
Residual factor for significantly intense reflections	0.0724
Weighted residual factors for all reflections	0.2197
Weighted residual factors for significantly intense reflections	0.1947
Weighted residual factors for all reflections included in the refinement	0.2196
Goodness-of-fit parameter for all reflections included in the refinement	0.9588
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
178966 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/95.	4119539.cif
103697	2014-03-06	cif/ Adding structures of 4119539 via cif-deposit CGI script.	4119539.cif