Crystallography Open Database

Information card for entry 4330395

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Coordinates	4330395.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H6 N8 O Zn
Calculated formula	C4.08 H6.06 N8.16 O Zn
Title of publication	A Zeolite-Like Zinc Triazolate Framework with High Gas Adsorption and Separation Performance
Authors of publication	Rui-Biao Lin; Da Chen; Yan-Yong Lin; Jie-Peng Zhang; Xiao-Ming Chen
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	9950 - 9955
a	13.9429 ± 0.0016 Å
b	13.9429 ± 0.0016 Å
c	13.9429 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	2710.6 ± 0.5 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	5
Space group number	227
Hermann-Mauguin space group symbol	F d -3 m :2
Hall space group symbol	-F 4vw 2vw 3
Residual factor for all reflections	0.0882
Residual factor for significantly intense reflections	0.0758
Weighted residual factors for significantly intense reflections	0.1593
Weighted residual factors for all reflections included in the refinement	0.1777
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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