Geometry & MOs

Info

ID:	409585
PubChem CID:	135082367
Reduced:	AuNC16H24 (1)
Stoich.:	ABC16D24 (1)
Weight, g/mol:	441.173095
ΔH_f, kcal/mol:	124.57
Dipole, Da:	2.99
IP(EA), eV:	-9.33(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethynylbenzene;gold(1+);nonan-1-amine

Drug info:

PubChemData

Smile

CCCCCCCCN.[C-]#CC1=CC=CC=C1.[Au+]

DOS

IR

Vibrations