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CIS,TRANS-[DIHYDRIDOBIS-(TRIPHENYLPHOSPHINE)-[N,C-2-PIPERIDINOPYRIDINE-1'-YLIDENE]-IRIDIUM-(III)]-FLUOROBORATE
SpectraBase Compound ID FwXsYgTOyUu
InChI InChI=1S/2C18H15P.C10H12N2.BF4.Ir.2H/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-4-8-12(9-5-1)10-6-2-3-7-11-10;2-1(3,4)5;;;/h2*1-15H;2-3,6-7H,1,4-5,8H2;;;;/q;;;2*-1;;/p+2
InChIKey UKHYMXNPRYYPNP-UHFFFAOYSA-P
Mol Weight 967.9 g/mol
Molecular Formula C46H46BF4IrN2P2
Exact Mass 968.279465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EZCBYTUrmxo
Name CIS,TRANS-[DIHYDRIDOBIS-(TRIPHENYLPHOSPHINE)-[N,C-2-PIPERIDINOPYRIDINE-1'-YLIDENE]-IRIDIUM-(III)]-FLUOROBORATE
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H44BF4IrN2P2
InChI InChI=1S/2C18H15P.C10H12N2.BF4.Ir.2H/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-4-8-12(9-5-1)10-6-2-3-7-11-10;2-1(3,4)5;;;/h2*1-15H;2-3,6-7H,1,4-5,8H2;;;;/q;;;2*-1;;/p+2
InChIKey UKHYMXNPRYYPNP-UHFFFAOYSA-P
Literature Reference Author E.CLOT,J.CHEN,D.H.LEE,S.Y.SUNG,L.N.APPELHANS,J.W.FALLER,R.H. CRABTREE,O.EISENSTEI
Literature Reference Citation J.AM.CHEM.SOC.,126,8795(2004)
Literature Reference DOI 10.1021/ja048473j
Molecular Weight 965.840 g/mol
Solvent CD2Cl2
Source File Reference UWVN31454