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PH4AS-[IR-(CO)2I3(COME)];MER,TRANS/CIS-ISOMER

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PH4AS-[IR-(CO)2I3(COME)];MER,TRANS/CIS-ISOMER
SpectraBase Compound ID Be7Eqx7feJ0
InChI InChI=1S/C24H20As.C2H3O.2CO.3HI.Ir/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-2-3;2*1-2;;;;/h1-20H;1H3;;;3*1H;/q+1;;;;;;;+2/p-3
InChIKey DRGLYQKCTFOTCF-UHFFFAOYSA-K
Mol Weight 1055.34 g/mol
Molecular Formula C28H23AsI3IrO3
Exact Mass 1055.762649 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3enPR5qyvWm
Name PH4AS-[IR-(CO)2I3(COME)];FAC,CIS-ISOMER
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H23AsI3IrO3
InChI InChI=1S/C24H20As.C2H3O.2CO.3HI.Ir/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-2-3;2*1-2;;;;/h1-20H;1H3;;;3*1H;/q+1;;;;;;;+2/p-3
InChIKey DRGLYQKCTFOTCF-UHFFFAOYSA-K
Literature Reference Author A.HAYNES,P.M.MAITLIS,G.E.MORRIS,G.J.SUNLEY,H.ADAMS,P.W.BADGE R,C.M.BOWERS,D.B.COO
Literature Reference Citation J.AM.CHEM.SOC.,126,2847(2004)
Literature Reference DOI 10.1021/ja039464y
Molecular Weight 1055.344 g/mol
Solvent CD3OD:CD2Cl2
Source File Reference UWVN32406