Crystallography Open Database

Information card for entry 1565789

Preview

Coordinates	1565789.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C68 H75 Mn2 N8 O13.5
Calculated formula	C68 H74 Mn2 N8 O13.5
Title of publication	Synthesis and crystal structure of a Mn-based coordination complex as precursor for the synthesis of Mn2O3
Authors of publication	Wang, Ao; Huang, Peng-Bin; Sun, Ping-Ping; Shi, Fa-Nian; Tian, Bo; Gao, Jun
Journal of publication	Inorganica Chimica Acta
Year of publication	2019
Journal volume	498
Pages of publication	119166
a	11.9986 ± 0.0002 Å
b	12.8222 ± 0.0002 Å
c	20.1046 ± 0.0003 Å
α	89.724 ± 0.001°
β	88.561 ± 0.001°
γ	85.736 ± 0.001°
Cell volume	3083.51 ± 0.08 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0671
Residual factor for significantly intense reflections	0.056
Weighted residual factors for significantly intense reflections	0.1418
Weighted residual factors for all reflections included in the refinement	0.1493
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation wavelength	0.71073 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/1565789.html