Crystallography Open Database

Information card for entry 2100506

Preview

Coordinates	2100506.cif
Original IUCr paper	HTML

Structure parameters

Formula	C2 Ca F6 O6 S2
Calculated formula	C2 Ca F5.99994 O5.99994 S2
Title of publication	Crystal structures of the trifluoromethyl sulfonates M(SO~3~CF~3~)~2~ (M = Mg, Ca, Ba, Zn, Cu) from synchrotron X-ray powder diffraction data
Authors of publication	Dinnebier, Robert; Sofina, Natalia; Hildebrandt, Lars; Jansen, Martin
Journal of publication	Acta Crystallographica, Section B: Structural Science
Year of publication	2006
Journal volume	62
Journal issue	3
Pages of publication	467 - 473
a	5.60549 ± 0.00003 Å
b	5.605486 Å
c	31.1417 ± 0.0002 Å
α	90°
β	90°
γ	120°
Cell volume	847.42 ± 0.01 Å³
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Goodness-of-fit parameter for all reflections	2.29
Diffraction radiation wavelength	0.69953 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Version history is temporarily not available due to server issues.