Crystallography Open Database

Information card for entry 4128652

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Coordinates	4128652.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H6 Co N4
Calculated formula	C6 H6 Co N4
Title of publication	Meltable Mixed-Linker Zeolitic Imidazolate Frameworks and Their Microporous Glasses: From Melting Point Engineering to Selective Hydrocarbon Sorption.
Authors of publication	Frentzel-Beyme, Louis; Kloß, Marvin; Kolodzeiski, Pascal; Pallach, Roman; Henke, Sebastian
Journal of publication	Journal of the American Chemical Society
Year of publication	2019
Journal volume	141
Journal issue	31
Pages of publication	12362 - 12371
a	15.591 ± 0.005 Å
b	15.606 ± 0.004 Å
c	18.103 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	4405 ± 2 Å³
Cell temperature	400 ± 2 K
Ambient diffraction temperature	400 ± 2 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.071
Residual factor for significantly intense reflections	0.0372
Weighted residual factors for significantly intense reflections	0.0993
Weighted residual factors for all reflections included in the refinement	0.1238
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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