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[[(ETA(5)-C5H5)-(PPH3)(2)-RU]=C=C(PH)-C-(CN)-CPH3]
SpectraBase Compound ID 34qd2Zct5Rp
InChI InChI=1S/C29H20N.2C18H15P.C5H.Ru/c30-22-28(21-27(28)23-13-5-1-6-14-23)29(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-5-3-1;/h1-20H;2*1-15H;1H;/q;;;;-2/p+2
InChIKey RFQJHXAZBHJQGQ-UHFFFAOYSA-P
Mol Weight 1071.2 g/mol
Molecular Formula C70H53NP2Ru
Exact Mass 1071.269665 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6HSvMGnm7qz
Name [[(ETA(5)-C5H5)-(PPH3)(2)-RU]=C=C(PH)-C-(CN)-CPH3]
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C70H51NP2Ru
InChI InChI=1S/C29H20N.2C18H15P.C5H.Ru/c30-22-28(21-27(28)23-13-5-1-6-14-23)29(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-5-3-1;/h1-20H;2*1-15H;1H;/q;;;;-2/p+2
InChIKey RFQJHXAZBHJQGQ-UHFFFAOYSA-P
Literature Reference Author P.C.TING,Y.C.LIN,G.H.LEE,M.C.CHENG,Y.WANG
Literature Reference Citation J.AM.CHEM.SOC.,118,6433(1996)
Literature Reference DOI 10.1021/ja960001k
Solvent CDCl3
Source File Reference UWSI36745