Crystallography Open Database

Information card for entry 4315881

Preview

Coordinates	4315881.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H24 Mn N5 O4
Calculated formula	C22 H24 Mn N5 O4
Title of publication	Synthesis, Structures, and Magnetism of Three 1D MnIII Chains with Oxazoline-Based Ligands
Authors of publication	Yan Zhang; Xiu-Teng Wang; Xiao-Man Zhang; Tian-Fu Liu; Wen-Guo Xu; Song Gao
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	5868 - 5875
a	10.05 ± 0.005 Å
b	10.525 ± 0.006 Å
c	11.158 ± 0.006 Å
α	96.949 ± 0.009°
β	103.657 ± 0.009°
γ	99.462 ± 0.009°
Cell volume	1115.4 ± 1 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 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	0.1021
Residual factor for significantly intense reflections	0.0775
Weighted residual factors for significantly intense reflections	0.1645
Weighted residual factors for all reflections included in the refinement	0.1735
Goodness-of-fit parameter for all reflections included in the refinement	0.835
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/4315881.html