Crystallography Open Database

Information card for entry 7063294

Preview

Coordinates	7063294.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H13 I N2
Calculated formula	C7 H13 I N2
Title of publication	A dime a dozen: common structural attributes of 1,2-dimethylimidazolium halide ionic liquids
Authors of publication	Scheuren, Marija; Sommers, Rachel C.; Boucher, Mairead; Carlos, Christiane; Hillesheim, Patrick C.
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	29
Pages of publication	13069 - 13079
a	9.0499 ± 0.0004 Å
b	7.8198 ± 0.0003 Å
c	13.5789 ± 0.0005 Å
α	90°
β	95.844 ± 0.001°
γ	90°
Cell volume	955.96 ± 0.07 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0243
Residual factor for significantly intense reflections	0.0216
Weighted residual factors for significantly intense reflections	0.0432
Weighted residual factors for all reflections included in the refinement	0.0439
Goodness-of-fit parameter for all reflections included in the refinement	1.195
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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