Crystallography Open Database

Information card for entry 7105607

Preview

Coordinates	7105607.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H8 Br0.8 Cl1.2 N6 Zn
Calculated formula	C6 H8 Br0.8 Cl1.2 N6 Zn
Title of publication	A general design platform for ionic liquid ions based on bridged multi-heterocycles with flexible symmetry and charge
Authors of publication	Drab, David M.; Shamshina, Julia L.; Smiglak, Marcin; Hines, C. Corey; Cordes, David B.; Rogers, Robin D.
Journal of publication	Chemical Communications
Year of publication	2010
Journal volume	46
Journal issue	20
Pages of publication	3544
a	6.5163 ± 0.0004 Å
b	9.5129 ± 0.0006 Å
c	17.9703 ± 0.0012 Å
α	90°
β	97.924 ± 0.001°
γ	90°
Cell volume	1103.32 ± 0.12 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
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	0.0558
Residual factor for significantly intense reflections	0.0461
Weighted residual factors for significantly intense reflections	0.1333
Weighted residual factors for all reflections included in the refinement	0.1395
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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