Geometry & MOs

Info

ID:	178932
PubChem CID:	76402900
Reduced:	ON4C18H22 (1)
Stoich.:	AB4C18D22 (1)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	56.34
Dipole, Da:	8.46
IP(EA), eV:	-9.13(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-[4-(1H-indol-3-yl)butanoyl]-N-propan-2-ylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CCN1C=CC=N1)CC2C=C3C=C(C=CC3=NC2=O)C

DOS

IR

Vibrations