Geometry & MOs

Info

ID:	235461
PubChem CID:	92709707
Reduced:	ClON2C21H21 (1)
Stoich.:	ABC2D21E21 (1)
Weight, g/mol:	332.188863
ΔH_f, kcal/mol:	3.25
Dipole, Da:	3.51
IP(EA), eV:	-8.84(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(2-methylphenyl)-N-(2-phenylethyl)-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C[C@@H](C2=CC=CC=C2C)N3C=CC=C3)Cl

DOS

IR

Vibrations