Crystallography Open Database

Information card for entry 7111490

Preview

Coordinates	7111490.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H6 Mn O4
Calculated formula	C12 H6 Mn O4
Title of publication	Diversity in magnetic properties of 3D isomorphous networks of Co(ii) and Mn(ii) constructed by napthalene-1,4-dicarboxylate
Authors of publication	Maji, Tapas Kumar; Kaneko, Wakako; Ohba, Masaaki; Kitagawa, Susumu
Journal of publication	Chemical Communications
Year of publication	2005
Journal issue	36
Pages of publication	4613 - 4615
a	4.892 ± 0.009 Å
b	14.99 ± 0.02 Å
c	13.37 ± 0.04 Å
α	90°
β	91.82 ± 0.06°
γ	90°
Cell volume	980 ± 4 Å³
Cell temperature	233.2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.0293
Weighted residual factors for all reflections included in the refinement	0.0395
Goodness-of-fit parameter for all reflections included in the refinement	0.889
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7111490.html