(4-Butyl-1-ethyl-1,2,4-triazol-5-yl-idene)[(1,2,5,6-η)-cyclo-octa-1,5-diene](tri-phenyl-phosphane)iridium(I) tetra-fluorido-borate
The title compound, [Ir(C H )(C H N )(C H P)]BF , a new triazole-based N-heterocyclic carbene iridium(I) cationic complex with a tetra-fluorido-borate counter-anion, crystallizes with two cations and two anions in the asymmetric unit of space group . The Ir centers of the cations have distorted squa...
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Veröffentlicht in: | IUCrData 2024-06, Vol.9 (Pt 6), p.x240501 |
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Hauptverfasser: | , , , |
Format: | Artikel |
Sprache: | eng |
Schlagworte: | |
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Zusammenfassung: | The title compound, [Ir(C
H
)(C
H
N
)(C
H
P)]BF
, a new triazole-based N-heterocyclic carbene iridium(I) cationic complex with a tetra-fluorido-borate counter-anion, crystallizes with two cations and two anions in the asymmetric unit of space group
. The Ir centers of the cations have distorted square-planar conformations, formed by a bidentate (η
+ η
) cyclo-octa-1,5-diene (COD) ligand, an N-heterocyclic carbene and a tri-phenyl-phosphane ligand with the NHC carbon atom and P atom being
. In the extended structure, non-classical C-H⋯F hydrogen bonds, one of which is notably short (H⋯F = 2.21 Å), link the cations and anions. The carbon atoms of one of the COD ligands are disordered over adjacent sites in a 0.62:0.38 ratio. |
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ISSN: | 2414-3146 |
DOI: | 10.1107/S2414314624005017 |