Crystallography Open Database

Information card for entry 1563045

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Coordinates	1563045.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H14 Mn N12 O6
Calculated formula	C14 H14 Mn N12 O6
Title of publication	A set of new transition metal-based coordination complexes dependent upon Hpztza ligand (Hpztza=2-(5-(pyrazin-2-yl)-2H-tetrazol-2-yl) acetic acid)
Authors of publication	Yang, Jie; Shen, Lei; Yang, Gao-Wen; Li, Qiao-Yun; Shen, Wei; Jin, Jian-Ning; Zhao, Jing-Jing; Dai, Jian
Journal of publication	Journal of Solid State Chemistry
Year of publication	2012
Journal volume	186
Pages of publication	124 - 133
a	7.1801 ± 0.0014 Å
b	9.6579 ± 0.0019 Å
c	13.937 ± 0.003 Å
α	90°
β	100.38 ± 0.03°
γ	90°
Cell volume	950.6 ± 0.3 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	5
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	0.084
Residual factor for significantly intense reflections	0.0612
Weighted residual factors for significantly intense reflections	0.1495
Weighted residual factors for all reflections included in the refinement	0.1624
Goodness-of-fit parameter for all reflections included in the refinement	1.1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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