Geometry & MOs

Info

ID:	235480
PubChem CID:	92709775
Reduced:	ON2C21H22 (1)
Stoich.:	AB2C21D22 (1)
Weight, g/mol:	304.157563
ΔH_f, kcal/mol:	11.87
Dipole, Da:	2.76
IP(EA), eV:	-8.83(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(2-methylphenyl)-N-phenyl-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations