Crystallography Open Database

Information card for entry 7117110

Preview

Coordinates	7117110.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H14 Al Mn N O12
Calculated formula	C8 H13.98 Al Mn N0.99 O12
Title of publication	A heterometallic strategy to achieve a large magnetocaloric effect in polymeric 3d complexes
Authors of publication	Jiong-Peng Zhao; Song-De Han; Xue Jiang; Sui-Jun Liu; Ran Zhao; Ze Chang; Xian-He Bu
Journal of publication	Chem.Commun.
Year of publication	2015
Journal volume	51
Pages of publication	8288
a	8.2179 ± 0.0012 Å
b	8.2179 ± 0.0012 Å
c	13.646 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	798.1 ± 0.2 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 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	0.0365
Residual factor for significantly intense reflections	0.0352
Weighted residual factors for significantly intense reflections	0.1018
Weighted residual factors for all reflections included in the refinement	0.1028
Goodness-of-fit parameter for all reflections included in the refinement	1.12
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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