Geometry & MOs

Info

ID:

340636

PubChem CID:

127262647

Reduced:

AuClPF3H13C18 (1)

Stoich.:

ABCD3E13F18 (1)

Weight, g/mol:

539.096986

ΔHf, kcal/mol:

-45.24

Dipole, Da:

12.58

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.997580

Charge, e:

 -1

Chem-info

IUPAC name:

carbanide;chlorogold;ethane;triphenylphosphanium

Drug info:

PubChemData

Smile

C1=CC(=CC=C1F)[PH+](C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.Cl[Au]

DOS

IR

Vibrations