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ETA-(6)-BENZENEDICARBONYL-[[2-(METHYLTHIO)-PYRROLYL]-DIPYRROLYLPHOSPHINE]-CHROMIUM-(0);X=H
SpectraBase Compound ID 3a94imVSN40
InChI InChI=1S/C13H14N3PS.C6.2CO.Cr/c1-18-13-7-6-12-16(13)17(14-8-2-3-9-14)15-10-4-5-11-15;1-2-4-6-5-3-1;2*1-2;/h2-12H,1H3;;;;/q;;;;-1/p+1
InChIKey WLPWJMXFVYGWAY-UHFFFAOYSA-O
Mol Weight 456.4 g/mol
Molecular Formula C21H15CrN3O2PS
Exact Mass 456.002765 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HnIRNA3j5Lc
Name ETA-(6)-BENZENEDICARBONYL-[[2-(METHYLTHIO)-PYRROLYL]-DIPYRROLYLPHOSPHINE]-CHROMIUM-(0);X=H
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H14CrN3O2PS
InChI InChI=1S/C13H14N3PS.C6.2CO.Cr/c1-18-13-7-6-12-16(13)17(14-8-2-3-9-14)15-10-4-5-11-15;1-2-4-6-5-3-1;2*1-2;/h2-12H,1H3;;;;/q;;;;-1/p+1
InChIKey WLPWJMXFVYGWAY-UHFFFAOYSA-O
Literature Reference Author M.F.SEMMELHACK,A.CHLENOV,L.WU,D.HO
Literature Reference Citation J.AM.CHEM.SOC.,123,8438(2001)
Literature Reference DOI 10.1021/ja0161150
Solvent C6D6
Source File Reference UWVN30238