Crystallography Open Database

Information card for entry 4346676

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Coordinates	4346676.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C89 H86 F36 N12 O28 Tb2
Calculated formula	C89 H86 F36 N12 O28 Tb2
Title of publication	Tuning Magnetic Relaxation in a Tb-Nitronyl Nitroxide Complex by Using Cocrystalline Paramagnetic Complex.
Authors of publication	Wang, Juan-Juan; Sun, Juan; Yang, Meng; Li, Li-Cun
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	23
Pages of publication	11307 - 11313
a	11.919 ± 0.002 Å
b	12.667 ± 0.003 Å
c	18.811 ± 0.004 Å
α	83.44 ± 0.03°
β	74.38 ± 0.03°
γ	84.24 ± 0.03°
Cell volume	2710.1 ± 1.1 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 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	0.0303
Residual factor for significantly intense reflections	0.0278
Weighted residual factors for significantly intense reflections	0.0812
Weighted residual factors for all reflections included in the refinement	0.0832
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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