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[(DIPPE)-NI-(ETA-(3)-ALLYL)]-(+)-[PH3-BC=NBPH3]-(-)

View entire compound with spectra: 2 NMR

[(DIPPE)-NI-(ETA-(3)-ALLYL)]-(+)-[PH3-BC=NBPH3]-(-)
SpectraBase Compound ID 6ZnKBJupEdC
InChI InChI=1S/C37H30B2N.C14H32P2.C3H3.Ni/c1-7-19-32(20-8-1)38(33-21-9-2-10-22-33,34-23-11-3-12-24-34)31-40-39(35-25-13-4-14-26-35,36-27-15-5-16-28-36)37-29-17-6-18-30-37;1-11(2)15(12(3)4)9-10-16(13(5)6)14(7)8;1-3-2;/h1-30H;11-14H,9-10H2,1-8H3;1H,2H2;/q-1;;;-1/p+2
InChIKey KZVHPOCVYFUUSE-UHFFFAOYSA-P
Mol Weight 872.4 g/mol
Molecular Formula C54H67B2NNiP2
Exact Mass 871.428827 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5M0TWBNScv2
Name [(DIPPE)-NI-(ETA-(3)-ALLYL)]-(+)-[PH3-BC=NBPH3]-(-)
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H65B2NNiP2
InChI InChI=1S/C37H30B2N.C14H32P2.C3H3.Ni/c1-7-19-32(20-8-1)38(33-21-9-2-10-22-33,34-23-11-3-12-24-34)31-40-39(35-25-13-4-14-26-35,36-27-15-5-16-28-36)37-29-17-6-18-30-37;1-11(2)15(12(3)4)9-10-16(13(5)6)14(7)8;1-3-2;/h1-30H;11-14H,9-10H2,1-8H3;1H,2H2;/q-1;;;-1/p+2
InChIKey KZVHPOCVYFUUSE-UHFFFAOYSA-P
Literature Reference Author N.M.BRUNKAN,D.M.BRESTENSKY,W.D.JONES
Literature Reference Citation J.AM.CHEM.SOC.,126,3627(2004)
Literature Reference DOI 10.1021/ja037002e
Solvent THF-D8
Source File Reference UWMZ24599