Geometry & MOs

Info

ID:	343850
PubChem CID:	127267026
Reduced:	ClN2O2C18H27 (1)
Stoich.:	AB2C2D18E27 (1)
Weight, g/mol:	257.152812
ΔH_f, kcal/mol:	-93.31
Dipole, Da:	1.88
IP(EA), eV:	-8.58(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-methylindol-2-yl)methyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CN1CCC(CC1)OC)C(=O)NCC2=CC=CC=C2Cl

DOS

IR

Vibrations