Crystallography Open Database

Information card for entry 7064215

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Coordinates	7064215.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H9 Cl3 N2 O Te
Calculated formula	C9 H9 Cl3 N2 O Te
Title of publication	From Fluorine Chemistry to Noncovalent Interactions: Celebrating Prof. Giuseppe Resnati
Authors of publication	MacDougall, Phillip; Zeng, Mich Wenshi; Wang, Jin; Ho, Peter Cheng-Wei; Vargas-Baca, Ignacio
Journal of publication	New Journal of Chemistry
Year of publication	2026
a	7.383 ± 0.002 Å
b	8.447 ± 0.003 Å
c	12.114 ± 0.004 Å
α	107.25 ± 0.02°
β	91.93 ± 0.02°
γ	108.787 ± 0.01°
Cell volume	676.1 ± 0.4 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0448
Residual factor for significantly intense reflections	0.0392
Weighted residual factors for significantly intense reflections	0.1
Weighted residual factors for all reflections included in the refinement	0.1037
Goodness-of-fit parameter for all reflections included in the refinement	1.085
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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