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[(5-ETA-C5H5)2ZR(P(C6H2-2,4,6-TERT.-BUTYL3)CPH=CPH)]

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[(5-ETA-C5H5)2ZR(P(C6H2-2,4,6-TERT.-BUTYL3)CPH=CPH)]
SpectraBase Compound ID LKs5nolKyil
InChI InChI=1S/C32H39P.2C5H.Zr/c1-30(2,3)25-21-26(31(4,5)6)29(27(22-25)32(7,8)9)33-28(24-18-14-11-15-19-24)20-23-16-12-10-13-17-23;2*1-2-4-5-3-1;/h10-19,21-22H,1-9H3;2*1H;/q-1;;;+1
InChIKey BEPLMPLNGNBVMQ-UHFFFAOYSA-N
Mol Weight 668.0 g/mol
Molecular Formula C42H41PZr
Exact Mass 666.199287 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BRjTxyPPFRm
Name [(5-ETA-C5H5)2ZR(P(C6H2-2,4,6-TERT.-BUTYL3)CPH=CPH)]
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H41PZr
InChI InChI=1S/C32H39P.2C5H.Zr/c1-30(2,3)25-21-26(31(4,5)6)29(27(22-25)32(7,8)9)33-28(24-18-14-11-15-19-24)20-23-16-12-10-13-17-23;2*1-2-4-5-3-1;/h10-19,21-22H,1-9H3;2*1H;/q-1;;;+1
InChIKey BEPLMPLNGNBVMQ-UHFFFAOYSA-N
Literature Reference Author T.L.BEEN,D.W.STEPHAN
Literature Reference Citation J.AM.CHEM.SOC.,118,4204(1996)
Literature Reference DOI 10.1021/ja953470f
Solvent C6D6
Source File Reference UWLU56304