Crystallography Open Database

Information card for entry 2300283

Preview

Coordinates	2300283.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Titanium oxydifluoride
Formula	F2 O Ti
Calculated formula	F2 O0.999999 Ti
Title of publication	Hexagonal and cubic TiOF~2~
Authors of publication	Shian, Samuel; Sandhage, Kenneth H.
Journal of publication	Journal of Applied Crystallography
Year of publication	2010
Journal volume	43
Journal issue	4
Pages of publication	757 - 761
a	5.3325 ± 0.0001 Å
b	5.3325 ± 0.0001 Å
c	13.2321 ± 0.0004 Å
α	90°
β	90°
γ	120°
Cell volume	325.853 ± 0.013 Å³
Ambient diffraction temperature	298 K
Number of distinct elements	3
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for significantly intense reflections	9.7
Weighted residual factors for all reflections included in the refinement	12.64
Goodness-of-fit parameter for all reflections included in the refinement	1.64
Method of determination	powder diffraction
Diffraction radiation wavelength	1.5406 Å
Diffraction radiation type	CuKα~1~
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	2300283.cif
120072	2014-07-11	Adding DOIs to range 2 structures.	2300283.cif
26848	2011-09-28	cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree.	2300283.cif
5310	2011-01-02	cif/ Running cif_fix_enum with the core CIF dictionary on COD ranges 2, 8 and 9. Range 9 remained unchanged, and in ranges 2 and 8 there were 17309 modified files, most changes were fixes enumerator case.	2300283.cif
4084	2010-12-16	cif/2/ Adding processed CIFs from J-Appl-Cryst-2010_04/.	2300283.cif