2-{Bis[3,5-bis(trifluoromethyl)phenyl]phosphino}-3,6-dimethoxy -2',4',6'-triisopropyl-1,1'-biphenyl gold(I) bis (trifluoromethylsulfonyl)imide

Catalog Number	ACM1801374548
CAS	1801374-54-8
Synonyms	Bis[3,5-bis(trifluoromethyl)phenyl]-[3,6-dimethoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphanium;bis(trifluoromethylsulfonyl)azanide;gold(1+)
Molecular Weight	1274.79
Molecular Formula	C41H38AuF18NO6PS2
Canonical SMILES	CC(C)C1=CC(=C(C(=C1)C(C)C)C2=C(C=CC(=C2[PH+](C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)OC)OC)C(C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.[Au+]
InChI	InChI=1S/C39H37F12O2P.C2F6NO4S2.Au/c1-19(2)22-11-29(20(3)4)33(30(12-22)21(5)6)34-31(52-7)9-10-32(53-8)35(34)54(27-15-23(36(40,41)42)13-24(16-27)37(43,44)45)28-17-25(38(46,47)48)14-26(18-28)39(49,50)51;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/h9-21H,1-8H3;/q;-1;+1/p+1
InChI Key	NILUVDCJFYCCDF-UHFFFAOYSA-O
Purity	97%
Complexity	1710
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Exact Mass	1274.125644
Heavy Atom Count	70
Hydrogen Bond Acceptor Count	25
Hydrogen Bond Donor Count	0
Monoisotopic Mass	1274.125644
Rotatable Bond Count	11
Topological Polar Surface Area	105 Ų