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THERMODYNAMIC
SpectraBase Compound ID 1TxtER5X5VE
InChI InChI=1S/C26H24P2.CF3.CO.2HI.Ir/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2-1(3)4;1-2;;;/h1-20H,21-22H2;;;2*1H;
InChIKey CYPQNPLEGCMCOT-UHFFFAOYSA-N
Mol Weight 943.48 g/mol
Molecular Formula C28H26F3I2IrOP2
Exact Mass 943.912963 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jgd97fhiKxE
Name THERMODYNAMIC
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H24F3I2IrOP2
InChI InChI=1S/C26H24P2.CF3.CO.2HI.Ir/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2-1(3)4;1-2;;;/h1-20H,21-22H2;;;2*1H;
InChIKey CYPQNPLEGCMCOT-UHFFFAOYSA-N
Literature Reference Author P.J.ALBIETZ,B.P.CLEARY,W.PAW,R.EISENBERG
Literature Reference Citation J.AM.CHEM.SOC.,123,12091(2001)
Literature Reference DOI 10.1021/ja016127l
Molecular Weight 941.470 g/mol
Solvent CD2Cl2
Source File Reference UWSI23997