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(S)-TOL-BINAP-PALLADIUM-(II)-NITRILE-COMPLEX

View entire compound with spectra: 1 NMR

(S)-TOL-BINAP-PALLADIUM-(II)-NITRILE-COMPLEX
SpectraBase Compound ID 1zntnrTRZ7h
InChI InChI=1S/C48H40P2.2C2H3N.2BF4.Pd/c1-33-13-23-39(24-14-33)49(40-25-15-34(2)16-26-40)45-31-21-37-9-5-7-11-43(37)47(45)48-44-12-8-6-10-38(44)22-32-46(48)50(41-27-17-35(3)18-28-41)42-29-19-36(4)20-30-42;2*1-2-3;2*2-1(3,4)5;/h5-32H,1-4H3;2*1H3;;;/q;;;2*-1;/p+2
InChIKey SWDXXJVYNCIEPW-UHFFFAOYSA-P
Mol Weight 1042.9 g/mol
Molecular Formula C52H48B2F8N2P2Pd
Exact Mass 1042.238589 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HUXnPJWg74W
Name (S)-TOL-BINAP-PALLADIUM-(II)-NITRILE-COMPLEX
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H46B2F8N2P2Pd
InChI InChI=1S/C48H40P2.2C2H3N.2BF4.Pd/c1-33-13-23-39(24-14-33)49(40-25-15-34(2)16-26-40)45-31-21-37-9-5-7-11-43(37)47(45)48-44-12-8-6-10-38(44)22-32-46(48)50(41-27-17-35(3)18-28-41)42-29-19-36(4)20-30-42;2*1-2-3;2*2-1(3,4)5;/h5-32H,1-4H3;2*1H3;;;/q;;;2*-1;/p+2
InChIKey SWDXXJVYNCIEPW-UHFFFAOYSA-P
Literature Reference Author K.HORI,H.KODAMA,T.OHTA,I.FURUKAWA
Literature Reference Citation J.ORG.CHEM.,64,5017(1999)
Literature Reference DOI 10.1021/jo981483g
Solvent CDCl3
Source File Reference UWSI40251