Crystallography Open Database

Information card for entry 7700036

Preview

Coordinates	7700036.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H17 Mn2 Mo N8 O5
Calculated formula	C11 H17 Mn2 Mo N8 O5
Title of publication	Two three-dimensional [Mo<sup>III</sup>(CN)<sub>7</sub>]<sup>4-</sup>-based magnets showing new topologies and ferrimagnetic ordering below 80 K.
Authors of publication	Wei, Xiao-Qin; Wang, Kang-Jie; Wu, Dong-Qing; Shao, Dong; Shi, Le; Shen, Fu-Xing; Wei, Hai-Yan; Wang, Xin-Yi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	24
Pages of publication	8843 - 8852
a	7.961 ± 0.006 Å
b	8.932 ± 0.006 Å
c	14.02 ± 0.01 Å
α	93.206 ± 0.011°
β	92.618 ± 0.011°
γ	107.265 ± 0.01°
Cell volume	948.5 ± 1.2 Å³
Cell temperature	153 K
Ambient diffraction temperature	153 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1011
Residual factor for significantly intense reflections	0.0633
Weighted residual factors for significantly intense reflections	0.1504
Weighted residual factors for all reflections included in the refinement	0.1723
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
223792 (current)	2019-11-07	cif/ Updating files of 7700036, 7700037 Original log message: Adding full bibliography for 7700036--7700037.cif.	7700036.cif
215340	2019-05-21	cif/ Adding structures of 7700036, 7700037 via cif-deposit CGI script.	7700036.cif