![[1,3-Bis(2,6-di-i-propylphenyl)-4,5-dihydroimidazol-2-ylidene]-[2-i-propoxy-5-(trifluoroacetamido)phenyl]methyleneruthenium(II) dichloride M71-S1Pr](https://resource.alfa-chemistry.com/structure/1212008-99-5.gif)
Synonyms
1212008-99-5;MFCD12545950;(1,3-bis(2,6-diisopropylphenyl)imidazolidin-2-yliden;e)(2-isopropoxy-5-(2,2,2-trifluoroacetamido)benzylidene)ruthenium(VI) chloride;[1,3-Bis(2,6-di-i-propylphenyl)-4,5-dihydroimidazol-2-ylidene]-[2-i-propoxy-5-(trifluoroacetamido)phenyl]methyleneruthenium(II) dichloride;[1,3-Bis(2,6-di-i-propylphenyl)-4,5-dihydroimidazol-2-ylidene]-[2-i-propoxy-5-(trifluoroacetamido)phenyl]methyleneruthenium(II) dichloride M71-S1Pr;
IUPAC Name
[1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ylidene]-dichloro-[[2-propan-2-yloxy-5-[(2,2,2-trifluoroacetyl)amino]phenyl]methylidene]ruthenium;
Molecular Weight
821.813g/mol
Molecular Formula
C39H50Cl2F3N3O2Ru;
Canonical SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)N2CCN(C2=[Ru](=CC3=C(C=CC(=C3)NC(=O)C(F)(F)F)OC(C)C)(Cl)Cl)C4=C(C=CC=C4C(C)C)C(C)C;
InChI
InChI=1S/C27H38N2.C12H12F3NO2.2ClH.Ru/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;1-7(2)18-10-5-4-9(6-8(10)3)16-11(17)12(13,14)15;;;/h9-14,18-21H,15-16H2,1-8H3;3-7H,1-2H3,(H,16,17);2*1H;/q;;;;+2/p-2;
InChI Key
UKUOIAIRKSRWAN-UHFFFAOYSA-L;
Complexity
1180
Covalently-Bonded Unit Count
1
Exact Mass
821.228g/mol
H-Bond Acceptor
7
H-Bond Donor
1
Heavy Atom Count
50
Monoisotopic Mass
821.228g/mol
Rotatable Bond Count
10
Topological Polar Surface Area
44.8A^2
