Methanesulfonato[1,1'-bis(diphenylphosphino)ferrocene)](2'-amino-1,1'-biphenyl-2-yl)palladium(II)

Catalog Number	ACM1445086281-1
CAS	1445086-28-1
Synonyms	DPPF Palladacycle Gen. 3
Molecular Weight	935.2
Molecular Formula	C47H52FeNO3P2PdS
Canonical SMILES	CS(=O)(=O)O.C1CCC(C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1CCC(C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C([C-]=C1)C2=CC=CC=C2N.[Fe].[Pd]
InChI	InChI=1S/2C17H19P.C12H10N.CH4O3S.Fe.Pd/c2*1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h2*1-6,9-12,17H,7-8,13-14H2;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;-1;
InChI Key	BVQOTLRMGKKFGQ-UHFFFAOYSA-N
Purity	98%
Appearance	Yellow powder
Complexity	663
Covalently-Bonded Unit Count	6
Defined Atom Stereocenter Count	0
Exact Mass	934.15273
Heavy Atom Count	56
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Monoisotopic Mass	934.15273
Rotatable Bond Count	7
Topological Polar Surface Area	88.8 Ų