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[IR(CO)(DPPMS)I2ET];MAJOR-ISOMER

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[IR(CO)(DPPMS)I2ET];MAJOR-ISOMER
SpectraBase Compound ID 2yB6eyAeNJM
InChI InChI=1S/C25H22P2S.C2H5.CO.2HI.Ir/c28-27(24-17-9-3-10-18-24,25-19-11-4-12-20-25)21-26(22-13-5-1-6-14-22)23-15-7-2-8-16-23;2*1-2;;;/h1-20H,21H2;1H2,2H3;;2*1H;/q;;;;;+1/p-1
InChIKey WFAFNSWFYAKDJJ-UHFFFAOYSA-M
Mol Weight 920.56 g/mol
Molecular Formula C28H28I2IrOP2S
Exact Mass 920.905475 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8MSXsgiSFJy
Name [IR(CO)(DPPMS)I2ET];MINOR-ISOMER
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H27I2IrOP2S
InChI InChI=1S/C25H22P2S.C2H5.CO.2HI.Ir/c28-27(24-17-9-3-10-18-24,25-19-11-4-12-20-25)21-26(22-13-5-1-6-14-22)23-15-7-2-8-16-23;2*1-2;;;/h1-20H,21H2;1H2,2H3;;2*1H;/q;;;;;+1/p-1
InChIKey WFAFNSWFYAKDJJ-UHFFFAOYSA-M
Literature Reference Author L.GONSALVI,H.ADAMS,G.J.SUNLEY,E.DITZEL,A.HAYNES
Literature Reference Citation J.AM.CHEM.SOC.,124,13597(2002)
Literature Reference DOI 10.1021/ja0176191
Solvent CD2Cl2
Source File Reference UWLU48536