Crystallography Open Database

Information card for entry 4323975

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Coordinates	4323975.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Fe Te2 Zr6
Calculated formula	Fe Te2 Zr6
Title of publication	New Zr6MTe2 (M = Mn, Fe, Co, Ni, Ru, Pt), Zr6Fe0.6Se2.4, and Zr6Fe0.57S2.43 Intermetallics: Structural Links between Binary (Zr,Hf)3M Alloys and Porous Metal-Rich Tellurides
Authors of publication	Chwanchin Wang; Timothy Hughbanks
Journal of publication	Inorganic Chemistry
Year of publication	1996
Journal volume	35
Pages of publication	6987 - 6994
a	7.7515 ± 0.0005 Å
b	7.7515 ± 0.0005 Å
c	3.6262 ± 0.0006 Å
α	90°
β	90°
γ	120°
Cell volume	188.69 ± 0.04 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	189
Hermann-Mauguin space group symbol	P -6 2 m
Hall space group symbol	P -6 -2
Residual factor for all reflections	0.0237
Residual factor for significantly intense reflections	0.0218
Weighted residual factors for all reflections	0.057
Weighted residual factors for significantly intense reflections	0.0565
Goodness-of-fit parameter for all reflections	1.257
Goodness-of-fit parameter for significantly intense reflections	1.271
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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