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TRANS-[CPRUH2-[[S-(C),S-(P)]-P-(IP)-P-(PH)-PF]]-CF3CO2
SpectraBase Compound ID LOr8xpRLEMQ
InChI InChI=1S/C31H31P2.C5H.C2HF3O2.Fe.Ru.2H/c1-24(2)32(25(3)4)30-21-13-20-29(30)31(23-22-26-14-11-12-15-26)33(27-16-7-5-8-17-27)28-18-9-6-10-19-28;1-2-4-5-3-1;3-2(4,5)1(6)7;;;;/h5-10,13-14,16-19,24-25,31H,22-23H2,1-4H3;1H;(H,6,7);;;;/q;;;;-1;;/p+1/t31-;;;;;;/m0....../s1
InChIKey ZVKKESQLLCVWES-HWYSWELDSA-O
Mol Weight 800.6 g/mol
Molecular Formula C38H36F3FeO2P2Ru
Exact Mass 801.05354 g/mol
Parent InChIKey HIZHUPXKLVFTHP-WSRKNMNMSA-O
Enantiomer InChIKey ZVKKESQLLCVWES-ROIZMHBPSA-O
Racemate InChIKey ZVKKESQLLCVWES-UHFFFAOYSA-O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE-D6
Title Journal or Book Year
Monocyclopentadienylhydride Derivatives of Ruthenium:  Stereoselective Proton Transfer and Proton-Hydride Exchange in an Extremely Short Dihydrogen Bond Journal of the American Chemical Society 2004
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