Geometry & MOs

Info

ID:	139214
PubChem CID:	52492966
Reduced:	OSN4C20H22 (1)
Stoich.:	ABC4D20E22 (1)
Weight, g/mol:	393.168856
ΔH_f, kcal/mol:	36.31
Dipole, Da:	8.92
IP(EA), eV:	-8.84(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-butyl-1,3-dioxoisoindole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)SC3=NN=CN3C(C)C

DOS

IR

Vibrations