Geometry & MOs

Info

ID:	235494
PubChem CID:	92709829
Reduced:	OF2N2H18C20 (1)
Stoich.:	AB2C2D18E20 (1)
Weight, g/mol:	392.209993
ΔH_f, kcal/mol:	-70.08
Dipole, Da:	3.19
IP(EA), eV:	-9.08(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methylphenyl)-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations