Geometry & MOs

Info

ID:	235450
PubChem CID:	92709679
Reduced:	ON2C20H26 (1)
Stoich.:	AB2C20D26 (1)
Weight, g/mol:	348.183778
ΔH_f, kcal/mol:	-17.98
Dipole, Da:	4.88
IP(EA), eV:	-8.63(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-[(4-methoxyphenyl)methyl]-3-(2-methylphenyl)-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1[C@@H](CC(=O)N2CCCCCC2)N3C=CC=C3

DOS

IR

Vibrations