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Statements

Subject Item
n2:RIV%2F61989592%3A15310%2F10%3A10213203%21RIV11-GA0-15310___
rdf:type
skos:Concept n18:Vysledek
dcterms:description
Three simple ruthenium nitrosyl complexes of the compositions [Et4N][RuCl4(NO)(DMSO](-) (1), [Bu4N][RuCl4(NO)(DMSO)](-) (2), and [Ph(4)P][RuCl4(NO)(H2O].DMSO (3); where DMSO = dimethyl sulfoxide, Et = ethyl, Bu = butyl and Ph = phenyl, have been synthesized in the single crystal form and their molecular and crystal structures have been determined. The Ru(II) centre is six-coordinated by four chlorido ligands in the equatorial plane and by the N (from NO+) and O (from DMSO in 1 and 2, H2O in 3) atoms in the axial positions forming an RuCI4NO donor set. The complexes have been also characterized by infrared and electronic spectroscopies, conductivity measurements, and thermogravimetric (TG) and differential thermal (DTA) analyses. The spectroscopic investigation is consistent with the (Ru(NO))(6) formulation with NO+ coordinated to the diamagnetic Ru(II) centre. The geometries of the complex anions as well as spectroscopic properties were calculated at the B3LYP/LANL2DZ/cc-pVTZ level of theory. Three simple ruthenium nitrosyl complexes of the compositions [Et4N][RuCl4(NO)(DMSO](-) (1), [Bu4N][RuCl4(NO)(DMSO)](-) (2), and [Ph(4)P][RuCl4(NO)(H2O].DMSO (3); where DMSO = dimethyl sulfoxide, Et = ethyl, Bu = butyl and Ph = phenyl, have been synthesized in the single crystal form and their molecular and crystal structures have been determined. The Ru(II) centre is six-coordinated by four chlorido ligands in the equatorial plane and by the N (from NO+) and O (from DMSO in 1 and 2, H2O in 3) atoms in the axial positions forming an RuCI4NO donor set. The complexes have been also characterized by infrared and electronic spectroscopies, conductivity measurements, and thermogravimetric (TG) and differential thermal (DTA) analyses. The spectroscopic investigation is consistent with the (Ru(NO))(6) formulation with NO+ coordinated to the diamagnetic Ru(II) centre. The geometries of the complex anions as well as spectroscopic properties were calculated at the B3LYP/LANL2DZ/cc-pVTZ level of theory.
dcterms:title
X-ray structures and spectral characterization of simple ruthenium(II) nitrosyl complexes involving the [RuCl4(NO)(DMSO)]? or [RuCl4(NO)(H2O)]? complex anions X-ray structures and spectral characterization of simple ruthenium(II) nitrosyl complexes involving the [RuCl4(NO)(DMSO)]? or [RuCl4(NO)(H2O)]? complex anions
skos:prefLabel
X-ray structures and spectral characterization of simple ruthenium(II) nitrosyl complexes involving the [RuCl4(NO)(DMSO)]? or [RuCl4(NO)(H2O)]? complex anions X-ray structures and spectral characterization of simple ruthenium(II) nitrosyl complexes involving the [RuCl4(NO)(DMSO)]? or [RuCl4(NO)(H2O)]? complex anions
skos:notation
RIV/61989592:15310/10:10213203!RIV11-GA0-15310___
n3:aktivita
n17:Z n17:P
n3:aktivity
P(GP203/08/P436), Z(MSM6198959218)
n3:cisloPeriodika
1-3
n3:dodaniDat
n10:2011
n3:domaciTvurceVysledku
n4:9813608 n4:9388540 n4:2321459
n3:druhVysledku
n19:J
n3:duvernostUdaju
n15:S
n3:entitaPredkladatele
n13:predkladatel
n3:idSjednocenehoVysledku
299063
n3:idVysledku
RIV/61989592:15310/10:10213203
n3:jazykVysledku
n8:eng
n3:klicovaSlova
DFT calculations; Thermal analysis; Infrared spectroscopy; Nitrosyl; Crystal structures; Ruthenium(II) complexes
n3:klicoveSlovo
n5:Infrared%20spectroscopy n5:DFT%20calculations n5:Crystal%20structures n5:Ruthenium%28II%29%20complexes n5:Thermal%20analysis n5:Nitrosyl
n3:kodStatuVydavatele
NL - Nizozemsko
n3:kontrolniKodProRIV
[3C71718B7752]
n3:nazevZdroje
Journal of Molecular Structure
n3:obor
n7:CA
n3:pocetDomacichTvurcuVysledku
3
n3:pocetTvurcuVysledku
3
n3:projekt
n16:GP203%2F08%2FP436
n3:rokUplatneniVysledku
n10:2010
n3:svazekPeriodika
977
n3:tvurceVysledku
NOVOTNÁ, Radka TRÁVNÍČEK, Zdeněk MATIKOVÁ MAĽAROVÁ, Miroslava
n3:wos
000280498600028
n3:zamer
n6:MSM6198959218
s:issn
0022-2860
s:numberOfPages
7
n14:organizacniJednotka
15310