Geometry & MOs

Info

ID:

393922

PubChem CID:

135021962

Reduced:

AuNPS2O4F6C31H46 (1)

Stoich.:

ABCD2E4F6G31H46 (1)

Weight, g/mol:

1014.270007

ΔHf, kcal/mol:

-454.57

Dipole, Da:

16.91

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.750185

Charge, e:

 1

Chem-info

IUPAC name:

bis(trifluoromethylsulfonyl)azanide;dicyclohexyl-[3,6-dimethoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphanium;gold(1+)

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C(=C1)C(C)C)C2=CC=CC=C2[PH+](C(C)(C)C)C(C)(C)C)C(C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.[Au+]

DOS

IR

Vibrations