Geometry & MOs

Info

ID:	409875
PubChem CID:	135082662
Reduced:	OAu2Cl2P2H32C39 (1)
Stoich.:	AB2C2D2E32F39 (1)
Weight, g/mol:	428.021617
ΔH_f, kcal/mol:	336.63
Dipole, Da:	8.36
IP(EA), eV:	-8.74(-2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl(phenyl)phosphane;gold(1+);3,3,3-trifluoroprop-1-yne

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)P([CH-]C(=O)[CH-]P(C2=CC=CC=C2)(C3=CC=CC=C3)(C4=CC=CC=C4)Cl)(C5=CC=CC=C5)(C6=CC=CC=C6)Cl.[Au+].[Au+]

DOS

IR

Vibrations