Crystallography Open Database

Information card for entry 7041571

Preview

Coordinates	7041571.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H90 Mn4 Mo2 N34 O25
Calculated formula	C74 H90 Mn4 Mo2 N34 O25
Title of publication	Slow magnetic relaxation based on the anisotropic Ising-type magnetic coupling between the Mo(III) and Mn(II) centers.
Authors of publication	Wang, Kai; Xia, Bin; Wang, Qing-Lun; Ma, Yue; Liao, Dai-Zheng; Tang, Jinkui
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2017
Journal volume	46
Journal issue	4
Pages of publication	1042 - 1046
a	28.968 ± 0.006 Å
b	19.02 ± 0.004 Å
c	20.323 ± 0.004 Å
α	90°
β	97.67 ± 0.03°
γ	90°
Cell volume	11097 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1252
Residual factor for significantly intense reflections	0.1017
Weighted residual factors for significantly intense reflections	0.2652
Weighted residual factors for all reflections included in the refinement	0.2881
Goodness-of-fit parameter for all reflections included in the refinement	1.107
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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