Crystallography Open Database

Information card for entry 4115944

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Structure parameters

Formula	C16 H14 O4 Te2
Calculated formula	C16 H14 O4 Te2
SMILES	c1(c(cccc1)OC)C(=O)[Te][Te]C(=O)c1c(cccc1)OC
Title of publication	An Unusual Planar Diacyl Ditelluride (2-MeOC6H4COTe)2: The Origin of Its Planarity
Authors of publication	Osamu Niyomura; Shinzi Kato; Satoshi Inagaki
Journal of publication	Journal of the American Chemical Society
Year of publication	2000
Journal volume	122
Pages of publication	2132 - 2133
a	4.319 ± 0.007 Å
b	12.198 ± 0.008 Å
c	15.287 ± 0.007 Å
α	90°
β	94.6 ± 0.1°
γ	90°
Cell volume	802.8 ± 1.5 Å³
Cell temperature	193.2 K
Ambient diffraction temperature	193.2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0631
Residual factor for significantly intense reflections	0.0631
Weighted residual factors for significantly intense reflections	0.0767
Weighted residual factors for all reflections included in the refinement	0.0767
Goodness-of-fit parameter for all reflections included in the refinement	3.941
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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