Geometry & MOs

Info

ID:	235452
PubChem CID:	92709692
Reduced:	ON3C24H27 (1)
Stoich.:	AB3C24D27 (1)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	26.12
Dipole, Da:	3.96
IP(EA), eV:	-8.49(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methylphenyl)-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1[C@H](CC(=O)N2CCN(CC2)C3=CC=CC=C3)N4C=CC=C4

DOS

IR

Vibrations