Geometry & MOs

Info

ID:	232807
PubChem CID:	87577089
Reduced:	NH19C25 (1)
Stoich.:	AB19C25 (1)
Weight, g/mol:	361.215413
ΔH_f, kcal/mol:	138.85
Dipole, Da:	1.84
IP(EA), eV:	-7.44(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-3-(1H-indol-3-yl)-5,6-dimethyl-4-pyrrolidin-1-ylbenzamide

Drug info:

PubChemData

Smile

C1C=CC2=C3C=CC=CC3=C(C2=C1)N(C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations