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[(ETA(5)-C5ME5)RE(NO)(PPH3)]2(C12)

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[(ETA(5)-C5ME5)RE(NO)(PPH3)]2(C12)
SpectraBase Compound ID 2O6Wv3MlRsD
InChI InChI=1S/2C18H15P.C12.2C10H15.2NO.2Re/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-5-7-9-11-12-10-8-6-4-2;2*1-6-7(2)9(4)10(5)8(6)3;2*1-2;;/h2*1-15H;;2*1-5H3;;;;/q;;;;;2*-1;2*+1/p+2
InChIKey NPUJVJROPWJYHZ-UHFFFAOYSA-P
Mol Weight 1373.6 g/mol
Molecular Formula C68H62N2O2P2Re2
Exact Mass 1374.340157 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3zf03eFyTII
Name [(ETA(5)-C5ME5)RE(NO)(PPH3)]2(C12)
Compound Number REC12RE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C68H60N2O2P2Re2
InChI InChI=1S/2C18H15P.C12.2C10H15.2NO.2Re/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-5-7-9-11-12-10-8-6-4-2;2*1-6-7(2)9(4)10(5)8(6)3;2*1-2;;/h2*1-15H;;2*1-5H3;;;;/q;;;;;2*-1;2*+1/p+2
InChIKey NPUJVJROPWJYHZ-UHFFFAOYSA-P
Literature Reference Author R.DEMBINSKI,T.BARTIK,B.BARTIK,M.JAEGER,J.A.GLADYSZ
Literature Reference Citation J.AM.CHEM.SOC.,122,810(2000)
Literature Reference DOI 10.1021/ja992747z
Molecular Weight 1371.598 g/mol
Solvent C6D6