Crystallography Open Database

Information card for entry 4308965

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Coordinates	4308965.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Barium Titanium Iodate
Formula	Ba I6 O18 Ti
Calculated formula	Ba I6 O18 Ti
Title of publication	New d0 Transition Metal Iodates: Synthesis, Structure, and Characterization of BaTi(IO3)6, LaTiO(IO3)5, Ba2VO2(IO3)4.(IO3), K2MoO2(IO3)4, and BaMoO2(IO3)4.H2O
Authors of publication	Kang Min Ok; P. Shiv Halasyamani
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	2263 - 2271
a	11.4711 ± 0.001 Å
b	11.4711 ± 0.001 Å
c	11.1465 ± 0.0017 Å
α	90°
β	90°
γ	120°
Cell volume	1270.2 ± 0.2 Å³
Cell temperature	293 ± 0.2 K
Ambient diffraction temperature	293 ± 0.2 K
Number of distinct elements	4
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.023
Residual factor for significantly intense reflections	0.0221
Weighted residual factors for significantly intense reflections	0.058
Weighted residual factors for all reflections included in the refinement	0.0583
Goodness-of-fit parameter for all reflections included in the refinement	1.171
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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