Crystallography Open Database

Information card for entry 7225821

Preview

Coordinates	7225821.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H88 Br4 Fe4 N16 O24
Calculated formula	C62 H88 Br4 Fe4 N16 O24
Title of publication	Tetra-Fe(iii) and deca-Mn(iii) metallacrowns built from bis-salicylhydrazide ligands: synthesis, structures and magnetic properties
Authors of publication	Pan, Jia-li; Guo, Qian; Yang, Bing; Li, Yu-yi; Cao, Jin-ge; Meng, Xiang-gao; Xiao, Feng-ping
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	33
Pages of publication	6143
a	26.292 ± 0.005 Å
b	26.292 ± 0.005 Å
c	12.959 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	8958 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	88
Hermann-Mauguin space group symbol	I 41/a
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.1033
Residual factor for significantly intense reflections	0.0577
Weighted residual factors for significantly intense reflections	0.1471
Weighted residual factors for all reflections included in the refinement	0.1761
Goodness-of-fit parameter for all reflections included in the refinement	1.011
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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