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[IR-(PNP)-(H)-(C6H4BR)]-[PF6]

View entire compound with spectra: 2 NMR

[IR-(PNP)-(H)-(C6H4BR)]-[PF6]
SpectraBase Compound ID f73edQD3nk
InChI InChI=1S/C23H43NP2.C6H4Br.F6P.Ir.H/c1-20(2,3)25(21(4,5)6)16-18-14-13-15-19(24-18)17-26(22(7,8)9)23(10,11)12;7-6-4-2-1-3-5-6;1-7(2,3,4,5)6;;/h13-15H,16-17H2,1-12H3;1-4H;;;/q;;2*-1;/p+2
InChIKey AOYZCGLEVYMUMM-UHFFFAOYSA-P
Mol Weight 891.75890498 g/mol
Molecular Formula C29H50BrF6IrNP3
Exact Mass 891.187293 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ewlhbt9pi2K
Name [IR-(PNP)-(H)-(C6H4BR)]-[PF6]
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H48BrF6IrNP3
InChI InChI=1S/C23H43NP2.C6H4Br.F6P.Ir.H/c1-20(2,3)25(21(4,5)6)16-18-14-13-15-19(24-18)17-26(22(7,8)9)23(10,11)12;7-6-4-2-1-3-5-6;1-7(2,3,4,5)6;;/h13-15H,16-17H2,1-12H3;1-4H;;;/q;;2*-1;/p+2
InChIKey AOYZCGLEVYMUMM-UHFFFAOYSA-P
Literature Reference Author E.BEN-ARI,M.GANDELMAN,H.ROZENBERG,L.J.W.SHIMON,D.MILSTEIN
Literature Reference Citation J.AM.CHEM.SOC.,125,4714(2003)
Literature Reference DOI 10.1021/ja028362p
Solvent CD2Cl2
Source File Reference UWLU40918