Geometry & MOs

Info

ID:	235507
PubChem CID:	92709864
Reduced:	ON2C23H26 (1)
Stoich.:	AB2C23D26 (1)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	7.07
Dipole, Da:	3.94
IP(EA), eV:	-8.61(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)[C@H](CC(=O)NCCCC2=CC=CC=C2)N3C=CC=C3

DOS

IR

Vibrations