Crystallography Open Database

Information card for entry 7050845

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Coordinates	7050845.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H14 Mn N5 O2
Calculated formula	C18 H14 Mn N5 O2
Title of publication	Syntheses, structures, electrochemistry and magnetic properties of chain-like dicyanamide manganese(iii) and iron(iii) complexes with salen ligand
Authors of publication	Shi, Qian; Cao, Rong; Li, Xing; Luo, Junhua; Hong, Maochun; Chen, Zhongning
Journal of publication	New Journal of Chemistry
Year of publication	2002
Journal volume	26
Journal issue	10
Pages of publication	1397
a	11.2826 ± 0.0001 Å
b	17.0485 ± 0.0002 Å
c	17.5949 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	3384.4 ± 0.08 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0756
Residual factor for significantly intense reflections	0.0446
Weighted residual factors for significantly intense reflections	0.0921
Weighted residual factors for all reflections included in the refinement	0.1079
Goodness-of-fit parameter for all reflections included in the refinement	1.079
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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