Crystallography Open Database

Information card for entry 7114771

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Coordinates	7114771.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76 H68 N3 O12 Te3
Calculated formula	C76 H68 N3 O12 Te3
Title of publication	Macrocyclic multi-telluranes with hypervalent Te‒O apical linkages
Authors of publication	Kobayashi, Kenji; Izawa, Hiroyuki; Furukawa, Naomichi; Yamaguchi, Kentaro; Horn, Ernst
Journal of publication	Chemical Communications
Year of publication	2001
Journal issue	16
Pages of publication	1428
a	13.2525 ± 0.0008 Å
b	15.1873 ± 0.0009 Å
c	19.937 ± 0.001 Å
α	76.682 ± 0.001°
β	75.167 ± 0.001°
γ	65.688 ± 0.001°
Cell volume	3499.3 ± 0.3 Å³
Cell temperature	173.2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0554
Weighted residual factors for all reflections included in the refinement	0.082
Goodness-of-fit parameter for all reflections included in the refinement	3.437
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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