Synonyms
MFCD22988933;1437326-26-5;Chloro[(S,S)-N1-methylsulfonyl-1,2-diphenyl-N2-(3-phenylpropyl)-1,2-ethanediamine]ruthenium(II);[(S,S)-Teth-MsDPEN-RuCl], Ru 18.5%;Chloro{(1S,2S)-1,2-diphenyl-1-[(3-(6-phenyl)propyl)amino]-2-(methylsulfonylamido)}ruthenium(II) RuCl[(S,S)2teth-MsDpen];
IUPAC Name
chlororuthenium(1+);[(1S,2S)-1,2-diphenyl-2-(3-phenylpropylamino)ethyl]-methylsulfonylazanide;
Molecular Weight
544.072g/mol
Molecular Formula
C24H27ClN2O2RuS;
Canonical SMILES
CS(=O)(=O)[N-]C(C1=CC=CC=C1)C(C2=CC=CC=C2)NCCCC3=CC=CC=C3.Cl[Ru+];
InChI
InChI=1S/C24H27N2O2S.ClH.Ru/c1-29(27,28)26-24(22-17-9-4-10-18-22)23(21-15-7-3-8-16-21)25-19-11-14-20-12-5-2-6-13-20;;/h2-10,12-13,15-18,23-25H,11,14,19H2,1H3;1H;/q-1;;+2/p-1/t23-,24-;;/m0../s1;
InChI Key
BNUPYTHKEKTXRC-WLKYSPGFSA-M;
Complexity
554
Covalently-Bonded Unit Count
2
Defined Atom Stereocenter Count
2
Exact Mass
544.053g/mol
H-Bond Acceptor
4
H-Bond Donor
1
Heavy Atom Count
31
Monoisotopic Mass
544.053g/mol
Rotatable Bond Count
10
Topological Polar Surface Area
55.6A^2
