Crystallography Open Database

Information card for entry 7713184

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Coordinates	7713184.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H19 F24 Mn2 N6 O10
Calculated formula	C32 H19 F24 Mn2 N6 O10
Title of publication	Syntheses and magnetic properties of a bis-bidentate nitronyl nitroxide radical based on triazolopyrimidine and its metal complexes
Authors of publication	Xia, Cheng-Cai; Zhang, Xinyu; Zhang, Chengcheng; Li, Gang; Wei, Haiyan; Wang, Xin-Yi
Journal of publication	Dalton Transactions
Year of publication	2023
a	12.4524 ± 0.0007 Å
b	13.4497 ± 0.0007 Å
c	14.3873 ± 0.0006 Å
α	87.143 ± 0.002°
β	74.376 ± 0.002°
γ	77.281 ± 0.002°
Cell volume	2263.5 ± 0.2 Å³
Cell temperature	193 K
Ambient diffraction temperature	193 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	0.0588
Residual factor for significantly intense reflections	0.048
Weighted residual factors for significantly intense reflections	0.122
Weighted residual factors for all reflections included in the refinement	0.1306
Goodness-of-fit parameter for all reflections included in the refinement	1.022
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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