Geometry & MOs

Info

ID:	235485
PubChem CID:	92709793
Reduced:	OSN3C17H17 (1)
Stoich.:	ABC3D17E17 (1)
Weight, g/mol:	364.178693
ΔH_f, kcal/mol:	43.33
Dipole, Da:	3.88
IP(EA), eV:	-8.91(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(3,4-dimethoxyphenyl)-3-(3-methylphenyl)-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)[C@@H](CC(=O)NC2=NC=CS2)N3C=CC=C3

DOS

IR

Vibrations