Geometry & MOs

Info

ID:	341614
PubChem CID:	127264307
Reduced:	AuOPH23C25 (1)
Stoich.:	ABCD23E25 (1)
Weight, g/mol:	375.057708
ΔH_f, kcal/mol:	187.8
Dipole, Da:	8.11
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 2.175646
Charge, e:	1

Chem-info

IUPAC name:

ethynylbenzene;gold(1+);trimethylphosphanium

Drug info:

PubChemData

Smile

COC1=CC=CC=[C-]1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Au+]

DOS

IR

Vibrations