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Dichloro[rel-[N2(S)]-N1,N1-dimethyl-N2-[2-[(R)-phenylthio-κS]ethyl]-1,2-ethanediamine-κNN1,κN2](triphenylphosphine)ruthenium(II), compd. with dichloromethane

Catalog Number ACM1799787317-1
CAS 1799787-31-7
Synonyms Dichloro[rel-[N2(S)]-N1,N1-dimethyl-N2-[2-[(R)-phenylthio-κ
Molecular Weight 743.6
Molecular Formula C31H37Cl4N2PRuS
Canonical SMILES CN(C)CCNCCSC1=CC=CC=C1.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C(Cl)Cl.Cl[Ru]Cl
InChI InChI=1S/C18H15P.C12H20N2S.CH2Cl2.2ClH.Ru/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-14(2)10-8-13-9-11-15-12-6-4-3-5-7-12;2-1-3;/h1-15H;3-7,13H,8-11H2,1-2H3;1H2;2*1H;/q;+2/p-2
InChI Key QHMGFBGXCCIWAH-UHFFFAOYSA-L
Purity 98%
Appearance Burgundy crystal
Complexity 375
Covalently-Bonded Unit Count 4
Defined Atom Stereocenter Count 0
Exact Mass 744.018308
Heavy Atom Count 40
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
Monoisotopic Mass 742.021258
Rotatable Bond Count 10
Topological Polar Surface Area 40.6 Ų

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