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Isolation and structural comparison of Ru(II)-dnp complexes [dnp = 2,6-bis­(1,8-naphthyridin-2-yl)pyridine] with axially or equatorially coordinating NCS ligands

The mol­ecular and crystal structures of two ruthenium(II) complexes, viz. cis-aqua­[2,6-bis­(1,8-naphthyridin-2-yl)pyridine-κ(3) N,N′,N′′](thio­cyanato-κN)(tri­phen­yl­phosphine-κP)ruthenium(II) hexa­fluorido­phosphate–acetone–water (1/0.5/1), [Ru(NCS)(C(21)H(13)N(5))(C(18)H(15)P)(H(2)O)]PF(6)·0.5C...

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Detalles Bibliográficos
Autores principales: Takase, Tsugiko, Yamanaka, Takashi, Tamura, Chihiro, Oyama, Dai
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9431777/
https://www.ncbi.nlm.nih.gov/pubmed/36072152
http://dx.doi.org/10.1107/S2056989022004443
Descripción
Sumario:The mol­ecular and crystal structures of two ruthenium(II) complexes, viz. cis-aqua­[2,6-bis­(1,8-naphthyridin-2-yl)pyridine-κ(3) N,N′,N′′](thio­cyanato-κN)(tri­phen­yl­phosphine-κP)ruthenium(II) hexa­fluorido­phosphate–acetone–water (1/0.5/1), [Ru(NCS)(C(21)H(13)N(5))(C(18)H(15)P)(H(2)O)]PF(6)·0.5C(3)H(6)O·H(2)O (I) and trans-[2,6-bis­(1,8-naphthyridin-2-yl)pyridine-κ(3)’N,N′,N′′]bis­(pyridine-κN)(thiocyanato-κN)ruthenium(II) thio­cyanate, [Ru(NCS)(C(21)H(13)N(5))(C(5)H(5)N)(2)]NCS (II), with an N-coordinating thio­cyanato group and a tridentate polypyridyl supporting ligand, are reported. The Ru(II) atom in each of the cationic complexes adopts a distorted octa­hedral coordination sphere, defined by an N atom of the thio­cyanato ligand, three N atoms from the tridentate polypyridyl ligand, and an O and P atom in (I) or two pyridine-N atoms in (II) derived from monodentate ligands. The thio­cyanato ligand in (I) coordinates in an axial manner to the {Ru-dnp} unit [dnp = 2,6-bis­(1,8-naphthyridin-2-yl)pyridine], whereas it coordinates in an equatorial manner in (II). In the crystal structure of compound (I), intra­molecular C—H⋯O, C—H⋯N and O—H⋯N hydrogen bonds as well as π–π contacts are present, in addition to inter­molecular C—H⋯F, C—H⋯O and O—H⋯O hydrogen bonds. In the crystal structure of compound (II), intra­molecular C—H⋯N hydrogen bonds are observed along with inter­molecular C—H⋯N and C—H⋯S hydrogen bonds as well as a π–π inter­action.