Geometry & MOs

Info

ID:	38718
PubChem CID:	8137813
Reduced:	N3O4C15H19 (1)
Stoich.:	A3B4C15D19 (1)
Weight, g/mol:	355.124215
ΔH_f, kcal/mol:	-142.27
Dipole, Da:	2.22
IP(EA), eV:	-9.28(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 3-phenylsulfanylpropanoate

Drug info:

PubChemData

Smile

CCOC(=O)NC1=CC=C(C=C1)C(=O)NCC(=O)NC2CC2

DOS

IR

Vibrations