John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=8YNjHdTDW52 SpectraBase Spectrum ID=2v78KQKSosS

(accessed ).
[(N,C(5),N-TPM)IR(PPH3)(C2H4)H]BF4
SpectraBase Compound ID 8YNjHdTDW52
InChI InChI=1S/C18H15P.C10H9N6.C2H2.BF4.Ir.H/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16;1-2;2-1(3,4)5;;/h1-15H;1-8,10H;1-2H;;;/q;-1;;-1;+1;/p+1
InChIKey HEINJSUXHCWGNG-UHFFFAOYSA-O
Mol Weight 781.6 g/mol
Molecular Formula C30H27BF4IrN6P
Exact Mass 782.169344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2v78KQKSosS
Name [(N,C(5),N-TPM)IR(PPH3)(C2H4)H]BF4
Compound Number 5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H27BF4IrN6P
InChI InChI=1S/C18H15P.C10H9N6.C2H2.BF4.Ir.H/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16;1-2;2-1(3,4)5;;/h1-15H;1-8,10H;1-2H;;;/q;-1;;-1;+1;/p+1
InChIKey HEINJSUXHCWGNG-UHFFFAOYSA-O
Literature Reference Author D.M.HEINEKEY,W.J.OLDHAM,J.S.WILEY
Literature Reference Citation J.AM.CHEM.SOC.,118,12842(1996)
Literature Reference DOI 10.1021/ja962320h
Molecular Weight 781.582 g/mol
Sample ID 54497
Solvent CD2Cl2
SpectraBase Batch ID 1XvGniJUA9q