Crystallography Open Database

Information card for entry 4331777

Preview

Coordinates	4331777.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H12 Au N13
Calculated formula	C4 H12 Au N13
SMILES	[Au](N=N#N)(N=N#N)(N=N#N)N=N#N.[N+](C)(C)(C)C
Title of publication	Highly Sensitive Ammonium Tetraazidoaurates(III)
Authors of publication	Klapötke, Thomas M.; Krumm, Burkhard; Galvez-Ruiz, Juan-Carlos; Nöth, Heinrich
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Journal issue	26
Pages of publication	9625 - 9627
a	9.973 ± 0.002 Å
b	10.246 ± 0.002 Å
c	13.625 ± 0.003 Å
α	94.14 ± 0.03°
β	93.63 ± 0.03°
γ	110.42 ± 0.03°
Cell volume	1295.5 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.07
Residual factor for significantly intense reflections	0.0444
Weighted residual factors for significantly intense reflections	0.1116
Weighted residual factors for all reflections included in the refinement	0.124
Goodness-of-fit parameter for all reflections included in the refinement	0.954
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	4310261
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
210300 (current)	2018-09-01	cif/4/ Updating bibliography in entries 4310261, 4331777. Marking entry 4331777 as a duplicate of entry 4310261.	4331777.cif
179420	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/17.	4331777.cif
153466	2015-08-16	cif/4 Fixing some Z values and formulae	4331777.cif
97881	2014-01-29	cif/ Adding structures of 4331777 via cif-deposit CGI script.	4331777.cif