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Dichloro[rel-[N(R)]-N-[2-[(R)-(phenylmethyl)thio-κS]ethyl]-4-morpholineethanamine-κNN4,κN4](triphenylphosphine)ruthenium(II), compd. with dichloromethane

Catalog Number ACM1799787293-1
CAS 1799787-29-3
Synonyms Dichloro[rel-[N(R)]-N-[2-[(R)-(phenylmethyl)thio-κ
Molecular Weight 799.62
Molecular Formula C34H41Cl4N2OPRuS
Canonical SMILES C1COCCN1CCNCCSCC2=CC=CC=C2.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C(Cl)Cl.Cl[Ru]Cl
InChI InChI=1S/C18H15P.C15H24N2OS.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;1-2-4-15(5-3-1)14-19-13-7-16-6-8-17-9-11-18-12-10-17;2-1-3;/h1-15H;1-5,16H,6-14H2;1H2;2*1H;/q;+2/p-2
InChI Key UEMAKRJTXZLFON-UHFFFAOYSA-L
Purity 98%
Appearance Red crystal
Complexity 448
Covalently-Bonded Unit Count 4
Defined Atom Stereocenter Count 0
Exact Mass 800.044523
Heavy Atom Count 44
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
Monoisotopic Mass 798.047473
Rotatable Bond Count 11
Topological Polar Surface Area 49.8 Ų

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