Crystallography Open Database

Information card for entry 4347505

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Coordinates	4347505.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H98 Mn4 N5 O29 Y
Calculated formula	C60 H98 Mn4 N5 O29 Y
Title of publication	Ferromagnetic Polarization: The Quantum Picture of Switching On/Off Single-Molecule Magnetism.
Authors of publication	Cao, Fan; Wei, Rong-Min; Li, Jing; Yang, Li; Han, Yuan; Song, You; Dou, Jian-Min
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	12
Pages of publication	5914 - 5923
a	17.588 ± 0.005 Å
b	17.588 ± 0.005 Å
c	11.615 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	3593 ± 1.9 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	6
Space group number	85
Hermann-Mauguin space group symbol	P 4/n :2
Hall space group symbol	-P 4a
Residual factor for all reflections	0.1121
Residual factor for significantly intense reflections	0.0837
Weighted residual factors for significantly intense reflections	0.2187
Weighted residual factors for all reflections included in the refinement	0.2341
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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