Geometry & MOs

Info

ID:	235514
PubChem CID:	92709880
Reduced:	ON2C22H24 (1)
Stoich.:	AB2C22D24 (1)
Weight, g/mol:	332.188863
ΔH_f, kcal/mol:	3.88
Dipole, Da:	3.97
IP(EA), eV:	-8.73(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(2,5-dimethylphenyl)-3-(3-methylphenyl)-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)[C@@H](CC(=O)NC2=C(C=CC(=C2)C)C)N3C=CC=C3

DOS

IR

Vibrations