Crystallography Open Database

Information card for entry 7713661

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Coordinates	7713661.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H64 B2 Fe2 N22 Ni O6
Calculated formula	C48 H63.9996 B2 Fe2 N22 Ni O6
Title of publication	Ferromagnetically coupled single-chain magnets exhibiting a magnetic hysteresis of 0.42 Tesla in cyano-bridged FeIII2MII (M = Ni, Fe) coordination polymers
Authors of publication	Wang, Jin-Hua; Javed, Mohammad Khurram; Li, Jia-Xin; Zhang, Yi-Quan; Li, Zhaoyang; Yamashita, Masahiro
Journal of publication	Dalton Transactions
Year of publication	2023
a	15.2745 ± 0.0005 Å
b	26.0846 ± 0.0015 Å
c	13.874 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	5527.8 ± 0.4 Å³
Cell temperature	126 ± 9 K
Ambient diffraction temperature	126 ± 9 K
Number of distinct elements	7
Space group number	72
Hermann-Mauguin space group symbol	I b a m
Hall space group symbol	-I 2 2c
Residual factor for all reflections	0.0827
Residual factor for significantly intense reflections	0.0693
Weighted residual factors for significantly intense reflections	0.1919
Weighted residual factors for all reflections included in the refinement	0.2043
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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