Crystallography Open Database

Information card for entry 7034474

Preview

Coordinates	7034474.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H18 Ag12 F12 N78 O48
Calculated formula	C24 H18 Ag12 F12 N78 O48
Title of publication	5-(Fluorodinitromethyl)-2H-tetrazole and its tetrazolates - Preparation and Characterization of New High Energy Compounds.
Authors of publication	Haiges, Ralf; Christe, Karl O.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	22
Pages of publication	10166 - 10176
a	15.427 ± 0.001 Å
b	15.4526 ± 0.001 Å
c	20.5225 ± 0.0013 Å
α	82.727 ± 0.001°
β	88.156 ± 0.001°
γ	82.669 ± 0.001°
Cell volume	4812.6 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1174
Residual factor for significantly intense reflections	0.0584
Weighted residual factors for significantly intense reflections	0.0977
Weighted residual factors for all reflections included in the refinement	0.1106
Goodness-of-fit parameter for all reflections included in the refinement	0.992
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
180050 (current)	2016-03-25	cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/44.	7034474.cif
138612	2015-06-07	cif/ Updating files of 7034468, 7034469, 7034470, 7034471, 7034472, 7034473, 7034474 Original log message: Adding full bibliography for 7034468--7034474.cif.	7034474.cif
134113	2015-03-19	cif/ Adding structures of 7034474 via cif-deposit CGI script.	7034474.cif