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[PDI(PPH3)2(NC(BR)N)]

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[PDI(PPH3)2(NC(BR)N)]
SpectraBase Compound ID LA0X4FscD8q
InChI InChI=1S/2C18H15P.C12H18BrN2.HI.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-14(2)8-10-6-5-7-11(12(10)13)9-15(3)4;;/h2*1-15H;6-7H,8-9H2,1-4H3;1H;/q;;;;-1/p+1
InChIKey QKNNDCJRDCSFQS-UHFFFAOYSA-O
Mol Weight 1030.1 g/mol
Molecular Formula C48H50BrIN2P2Pd
Exact Mass 1028.071212 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LpGJGYgGdg3
Name [PDI(PPH3)2(NC(BR)N)]
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H48BrIN2P2Pd
InChI InChI=1S/2C18H15P.C12H18BrN2.HI.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-14(2)8-10-6-5-7-11(12(10)13)9-15(3)4;;/h2*1-15H;6-7H,8-9H2,1-4H3;1H;/q;;;;-1/p+1
InChIKey QKNNDCJRDCSFQS-UHFFFAOYSA-O
Literature Reference Author G.RODRIGUEZ,M.ALBRECHT,J.SCHOENMAKER,A.FORD,M.LUTZ,A.L.SPEK, G.V.KOTEN
Literature Reference Citation J.AM.CHEM.SOC.,124,5127(2002)
Literature Reference DOI 10.1021/ja0177657
Solvent C6D6
Source File Reference UWLU49139