Crystallography Open Database

Information card for entry 7028650

Preview

Coordinates	7028650.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C80.5 H70.5 Fe2 Mn2 N17.5 O7.5
Calculated formula	C80.5 H70.5 Fe2 Mn2 N17.5 O7.5
Title of publication	The supramolecular interaction mediated chiral 1D cyanide-bridged metamagnet: synthesis, crystal structures and magnetic properties.
Authors of publication	Zhang, Daopeng; Bian, Yongzhong; Qin, Jie; Wang, Ping; Chen, Xia
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	3
Pages of publication	945 - 949
a	12.408 ± 0.0006 Å
b	20.4024 ± 0.0009 Å
c	15.0189 ± 0.0009 Å
α	90°
β	92.969 ± 0.005°
γ	90°
Cell volume	3797 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.1348
Residual factor for significantly intense reflections	0.0934
Weighted residual factors for significantly intense reflections	0.2226
Weighted residual factors for all reflections included in the refinement	0.2692
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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