Crystallography Open Database

Information card for entry 1561039

Preview

Coordinates	1561039.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H16 Mn3 N2 O12
Calculated formula	C20 H16 Mn3 N2 O12
Title of publication	Structures and magnetic properties of 3D manganese(II)- and 2D pillar-layered copper(II)-organic framework derived from mixed carboxylate ligands
Authors of publication	Zhai, Bin; Song, Li-Li; Wang, Wen-Jing; Li, Zhong-Yi; Li, Su-Zhi; Zhang, Fu-Li; Zhang, Chi; Zang, Yun-Bo
Journal of publication	Journal of Solid State Chemistry
Year of publication	2018
Journal volume	264
Pages of publication	29 - 34
a	17.6606 ± 0.0014 Å
b	6.9124 ± 0.0005 Å
c	9.3741 ± 0.0007 Å
α	90°
β	110.327 ± 0.005°
γ	90°
Cell volume	1073.1 ± 0.14 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0467
Residual factor for significantly intense reflections	0.0436
Weighted residual factors for significantly intense reflections	0.129
Weighted residual factors for all reflections included in the refinement	0.1306
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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