Geometry & MOs

Info

ID:	395412
PubChem CID:	135025396
Reduced:	ON2C24H28 (1)
Stoich.:	AB2C24D28 (1)
Weight, g/mol:	360.220164
ΔH_f, kcal/mol:	12.87
Dipole, Da:	4.56
IP(EA), eV:	-8.41(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-5-ethyl-5-[2-(1H-indol-2-yl)ethyl]piperidin-2-one

Drug info:

PubChemData

Smile

CCC1(CCC(=O)N(C1)CC2=CC=CC=C2)CCC#CC3=CC=CC=C3N

DOS

IR

Vibrations