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[5-ETA-C10H15(PME3)RH(H)(H2)]-[BAR'4]

View entire compound with spectra: 2 NMR

[5-ETA-C10H15(PME3)RH(H)(H2)]-[BAR'4]
SpectraBase Compound ID 1aBc487YVVM
InChI InChI=1S/C32H12BF24.C10H15.C3H9P.Rh.H2.H/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-6-7(2)9(4)10(5)8(6)3;1-4(2)3;;;/h1-12H;1-5H3;1-3H3;;1H;/q-1;;;;;/p+1
InChIKey HKPIMNBMFDTWTC-UHFFFAOYSA-O
Mol Weight 1181.47 g/mol
Molecular Formula C45H40BF24PRh
Exact Mass 1181.163234 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 60FyQ2ZoF1a
Name [5-ETA-C10H15(PME3)RH(H)(H2)]-[BAR'4]
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H39BF24PRh
InChI InChI=1S/C32H12BF24.C10H15.C3H9P.Rh.H2.H/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-6-7(2)9(4)10(5)8(6)3;1-4(2)3;;;/h1-12H;1-5H3;1-3H3;;1H;/q-1;;;;;/p+1
InChIKey HKPIMNBMFDTWTC-UHFFFAOYSA-O
Literature Reference Author F.L.TAW,H.MELLOWS,P.S.WHITE,F.J.HOLLANDER,R.G.BERGMAN,M.BROO KHART,D.M.HEINEKEY
Literature Reference Citation J.AM.CHEM.SOC.,124,5100(2002)
Literature Reference DOI 10.1021/ja0165990
Solvent CD2Cl2
Source File Reference UWLU49161