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[MO2-(ETA(5)-C5H5)(2)-(MIU-KAPPA(1):KAPPA(1),ETA(6)-P-(2,4,6-C6H2-T-BU3))-(CO)(2)]
SpectraBase Compound ID 2Dvi416hcrU
InChI InChI=1S/C18H27P.2C5H.2CO.2Mo/c1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9;2*1-2-4-5-3-1;2*1-2;;/h1-9H3;2*1H;;;;
InChIKey PCAYCTCDCIAEKA-UHFFFAOYSA-N
Mol Weight 644.44 g/mol
Molecular Formula C30H29Mo2O2P
Exact Mass 648.001325 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bn01tGR0RCw
Name [MO2-(ETA(5)-C5H5)(2)-(MIU-KAPPA(1):KAPPA(1),ETA(6)-P-(2,4,6-C6H2-T-BU3))-(CO)(2)]
Compound Number 3
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H29Mo2O2P
InChI InChI=1S/C18H27P.2C5H.2CO.2Mo/c1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9;2*1-2-4-5-3-1;2*1-2;;/h1-9H3;2*1H;;;;
InChIKey PCAYCTCDCIAEKA-UHFFFAOYSA-N
Literature Reference Author M.E.GARCIA,V.RIERA,M.A.RUIZ,D.SAEZ,H.HAMIDOV,J.C.JEFFERY,T.R IIS-JOHANNESSEN
Literature Reference Citation J.AM.CHEM.SOC.,125,13044(2003)
Literature Reference DOI 10.1021/ja037293r
Solvent CD2Cl2
Source File Reference UWSI35223