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(OC-6-35-A)-Aquadicarbonylchlorido[2-(2-pyridyl)-1,8-naphthyridine-κ;2N1,N2]ruthenium(II) hexafluoridophosphate 2,2-Bipyridine

1
Institute of Environmental Radioactivity, Fukushima University, 1 Kanayagawa, Fukushima 960-1296, Japan
2
Cluster of Science and Engineering, Fukushima University, 1 Kanayagawa, Fukushima 960-1296, Japan
*
Author to whom correspondence should be addressed.
Molbank 2017, 2017(3), M950; https://doi.org/10.3390/M950
Received: 20 July 2017 / Revised: 1 August 2017 / Accepted: 1 August 2017 / Published: 3 August 2017
(This article belongs to the Section Structure Determination)
A dicarbonylruthenium(II) complex containing bidentate 2-(2-pyridyl)-1,8-naphthyridine, as well as monodentate aqua and chlorido ligands, were isolated and characterized using spectroscopic techniques and single crystal X-ray diffraction. These data indicate that geometrical isomerization occurs during the substitution reaction involving a superacid. Density functional theory (DFT) calculations were performed on the plausible geometrical isomers. The DFT-optimized structures and calculated infrared spectra suggest that the experimentally obtained structure is stable. View Full-Text
Keywords: ruthenium complex; carbonyl; naphthyridine; X-ray diffraction; hydrogen-bonding; computational chemistry; vibrational spectroscopy ruthenium complex; carbonyl; naphthyridine; X-ray diffraction; hydrogen-bonding; computational chemistry; vibrational spectroscopy
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MDPI and ACS Style

Takase, T.; Abe, R.; Oyama, D. (OC-6-35-A)-Aquadicarbonylchlorido[2-(2-pyridyl)-1,8-naphthyridine-κ;2N1,N2]ruthenium(II) hexafluoridophosphate 2,2-Bipyridine. Molbank 2017, 2017, M950.

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