Crystallography Open Database

Information card for entry 7237173

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Coordinates	7237173.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	hexakis(2-aminotetrazolyl) zinc(II) diperchlorate *2 2-aminotetrazole
Chemical name	hexakis(2-aminotetrazolyl) zinc(II) diperchlorate *2 2-aminotetrazole
Formula	C8 H24 Cl2 N40 O8 Zn
Calculated formula	C8 H24 Cl2 N40 O8 Zn
Title of publication	Maximization of the energy capability level in transition metal complexes through application of 1-amino- and 2-amino-5H-tetrazole ligands
Authors of publication	Szimhardt, Norbert; Wurzenberger, Maximilian H. H.; Zeisel, Lukas; Gruhne, Michael S.; Lommel, Marcus; Stierstorfer, Jörg
Journal of publication	Journal of Materials Chemistry A
Year of publication	2018
Journal volume	6
Journal issue	33
Pages of publication	16257
a	8.5016 ± 0.0002 Å
b	10.8035 ± 0.0003 Å
c	19.2662 ± 0.0006 Å
α	79.175 ± 0.003°
β	86.1 ± 0.002°
γ	86.315 ± 0.002°
Cell volume	1731.63 ± 0.08 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 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	0.055
Residual factor for significantly intense reflections	0.0369
Weighted residual factors for significantly intense reflections	0.0789
Weighted residual factors for all reflections included in the refinement	0.0874
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
237469 (current)	2019-11-24	cif/ Adding structures of 7237167, 7237168, 7237169, 7237170, 7237171, 7237172, 7237173, 7237174, 7237175, 7237176, 7237177, 7237178, 7237179, 7237180, 7237181, 7237182, 7237183, 7237184, 7237185, 7237186 via cif-deposit CGI script.	7237173.cif