Geometry & MOs

Info

ID:	235493
PubChem CID:	92709828
Reduced:	ON2C19H24 (1)
Stoich.:	AB2C19D24 (1)
Weight, g/mol:	340.13872
ΔH_f, kcal/mol:	-22.27
Dipole, Da:	4.4
IP(EA), eV:	-8.55(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(2,4-difluorophenyl)-3-(3-methylphenyl)-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)[C@H](CC(=O)NC2CCCC2)N3C=CC=C3

DOS

IR

Vibrations