CAS 536724-67-1 Dichloro[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene](3-phenyl-1H-inden-1-ylidene)(tricyclohexylphosphine)ruthenium(II)

Synonyms

536724-67-1; Dichloro[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene](3-phenyl-1H-inden-1-ylidene)(tricyclohexylphosphine)ruthenium(II); BCP13985; TRICYCLOHEXYLPHOSPHINE[3-PHENYL-1H-INDEN-1-YLIDENE][1,3-BIS(2,4,6-TRIMETHYLPHENYL)-4,5-DIHYDROIMIDAZOL-2-YLIDENE]RUTHENIUM(II) DICHLORIDE; MFCD08667892; [1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-dichloro-(3-phenylinden-1-ylidene)ruthenium; Neolyst M 2; TRICYCLOHEXYLPHOSPHINE[3-PHENYL-1H-INDEN-1-YLIDENE][1,3-BIS(2,4,6-TRIMETHYLPHENYL)-4,5-DIHYDROIMIDAZOL-2-YLIDENE]RUTHENIUM (II) DICHLORIDE, MIN. 95% NEOLYST M2; AKOS032948007; SCHEMBL2230761;

IUPAC Name

[1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-dichloro-(3-phenylinden-1-ylidene)ruthenium;tricyclohexylphosphane;

Molecular Weight

949.104g/mol

Molecular Formula

C54H69Cl2N2PRu;

Canonical SMILES

CC1=CC(=C(C(=C1)C)N2CCN(C2=[Ru](=C3C=C(C4=CC=CC=C43)C5=CC=CC=C5)(Cl)Cl)C6=C(C=C(C=C6C)C)C)C.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3;

InChI

InChI=1S/C21H26N2.C18H33P.C15H10.2ClH.Ru/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15;;;/h9-12H,7-8H2,1-6H3;16-18H,1-15H2;1-9,11H;2*1H;/q;;;;;+2/p-2;

InChI Key

MCNUJWCJGIGFBS-UHFFFAOYSA-L;

Complexity

1240

Covalently-Bonded Unit Count

Exact Mass

948.362g/mol

H-Bond Acceptor

Heavy Atom Count

Monoisotopic Mass

948.362g/mol

Rotatable Bond Count

Topological Polar Surface Area

6.5A^2