Tricyclohexylphosphine[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene][2-thienylmethylene]ruthenium(II) dichloride

Catalog Number	ACM1190427496-2
CAS	1190427-49-6
Structure
Synonyms	[1,3-Bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]-dichloro-(thiophen-2-ylmethylidene)ruthenium;tricyclohexylphosphane
Molecular Weight	853
Molecular Formula	C44H61Cl2N2PRuS
Canonical SMILES	CC1=CC(=C(C(=C1)C)N2C=CN(C2=[Ru](=CC3=CC=CS3)(Cl)Cl)C4=C(C=C(C=C4C)C)C)C.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3
InChI	InChI=1S/C21H24N2.C18H33P.C5H4S.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;1-5-3-2-4-6-5;/h7-12H,1-6H3;16-18H,1-15H2;1-4H;2*1H;/q;+2/p-2
InChI Key	MRIHTAFCWLKGPP-UHFFFAOYSA-L
Purity	98%
Appearance	Powder
Exact Mass	852.271354
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Monoisotopic Mass	852.271354
Rotatable Bond Count	6
Topological Polar Surface Area	34.7 Ų