Crystallography Open Database

Information card for entry 7108506

Preview

Coordinates	7108506.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H22 B2 F8 Fe N24 O5.32
Calculated formula	C12 H22 B2 F8 Fe N24 O5.321
Title of publication	Crystal Engineering from a 1D Chain to a 3D Coordination Polymer Accompanied with a Dramatic Change in Magnetic Property
Authors of publication	Yu-Chun Chuang; Wei-Lun Ho; Chou-Fu Sheu; Gene-Hsiang Lee; Yu Wang
Journal of publication	Chem.Commun.
Year of publication	2012
Journal volume	48
Pages of publication	10769
a	11.2939 ± 0.0002 Å
b	11.4812 ± 0.0002 Å
c	13.0931 ± 0.0002 Å
α	112.121 ± 0.0009°
β	95.5478 ± 0.0011°
γ	91.2584 ± 0.0011°
Cell volume	1562.27 ± 0.05 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.107
Residual factor for significantly intense reflections	0.0599
Weighted residual factors for significantly intense reflections	0.1542
Weighted residual factors for all reflections included in the refinement	0.175
Goodness-of-fit parameter for all reflections included in the refinement	1.07
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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