Crystallography Open Database

Information card for entry 4317036

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Coordinates	4317036.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H14 Co Fe N O12
Calculated formula	C8 H13.98 Co Fe N0.99 O12
Title of publication	Magnetic Behavior Control in Niccolite Structural Metal Formate Frameworks [NH2(CH3)2][FeIIIMII(HCOO)6] (M = Fe, Mn, and Co) by Varying the Divalent Metal Ions
Authors of publication	Jiong-Peng Zhao; Bo-Wen Hu; Francesc Lloret; Jun Tao; Qian Yang; Xiao-Feng Zhang; Xian-He Bu
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	10390 - 10399
a	8.2486 ± 0.0012 Å
b	8.2486 ± 0.0012 Å
c	13.79 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	812.6 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	163
Hermann-Mauguin space group symbol	P -3 1 c
Hall space group symbol	-P 3 2c
Residual factor for all reflections	0.0324
Residual factor for significantly intense reflections	0.0296
Weighted residual factors for significantly intense reflections	0.0651
Weighted residual factors for all reflections included in the refinement	0.0664
Goodness-of-fit parameter for all reflections included in the refinement	1.259
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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