Geometry & MOs

Info

ID:	235506
PubChem CID:	92709861
Reduced:	ON3C24H27 (1)
Stoich.:	AB3C24D27 (1)
Weight, g/mol:	346.204513
ΔH_f, kcal/mol:	28.37
Dipole, Da:	5.96
IP(EA), eV:	-8.54(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(3-methylphenyl)-N-(3-phenylpropyl)-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