Geometry & MOs

Info

ID:

412587

PubChem CID:

135085484

Reduced:

AuS2N3O4F6C29H36 (1)

Stoich.:

AB2C3D4E6F29G36 (1)

Weight, g/mol:

1869.36996

ΔHf, kcal/mol:

-301.41

Dipole, Da:

5.25

IP(EA), eV:

 -9.04(-2.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[1-[2-[[(E)-(5-tert-butyl-3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]naphthalen-1-yl]naphthalen-2-yl]azanide;chlorogold;gold;gold(1+);triphenylphosphane

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN([C]2)C3=C(C=CC=C3C(C)C)C(C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.[Au+]

DOS

IR

Vibrations