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Palladium, [2'-(amino-κN)[1,1'-biphenyl]-2-yl-κC][1-[bis(1,1-dimethylethyl)phosphino-κP]-1'-[bis(1,1-dimethylethyl)phosphino]ferrocene](methanesulfonato-κO)- structure

Palladium, [2'-(amino-κN)[1,1'-biphenyl]-2-yl-κC][1-[bis(1,1-dimethylethyl)phosphino-κP]-1'-[bis(1,1-dimethylethyl)phosphino]ferrocene](methanesulfonato-κO)-

 
1. Names and Identifiers
1.1 Name
Palladium, [2'-(amino-κN)[1,1'-biphenyl]-2-yl-κC][1-[bis(1,1-dimethylethyl)phosphino-κP]-1'-[bis(1,1-dimethylethyl)phosphino]ferrocene](methanesulfonato-κO)-
1.2 Synonyms
Methanesulfonato(1,1-bis(di-t-butylphosphino)ferrocene)(2'-amino-1,1'-biphenyl-2-yl)palladium(II);
1.3 CAS No.
2408294-08-4
1.5 Molecular Formula
C39H49FeNO3P2PdS
1.6 Inchi
InChI=1/C13H19P.C13H18P.C12H9N.CH4O3S.Fe.Pd/c2*1-12(2,3)14(13(4,5)6)11-9-7-8-10-11;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;;/h14H,1-6H3;1-6H3;1-6,8-9,13H;1H3,(H,2,3,4);;/q;-1;-2;;2*+2/p-1
1.7 InChkey
KXCNHMWXFCHTJB-UHFFFAOYNA-M
1.8 Canonical Smiles
C1=2[C-]3(C4=C5[Fe++]1341346(C7=C1C3=C4[C-]67P([Pd++]1([O-]S(=O)(=O)C)[C-]3=CC=CC=C3C3=CC=CC=C3N1)(C(C)(C)C)C(C)(C)C)C=25)P(C(C)(C)C)C(C)(C)C
1.9 Isomers Smiles
C1=2[C-]3(C4=C5[Fe++]1341346(C7=C1C3=C4[C-]67P([Pd++]1([O-]S(=O)(=O)C)[C-]3=CC=CC=C3C3=CC=CC=C3N1)(C(C)(C)C)C(C)(C)C)C=25)P(C(C)(C)C)C(C)(C)C
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