Geometry & MOs

Info

ID:	38600
PubChem CID:	8137187
Reduced:	SN2O5C19H20 (1)
Stoich.:	AB2C5D19E20 (1)
Weight, g/mol:	265.131408
ΔH_f, kcal/mol:	-163.36
Dipole, Da:	2.39
IP(EA), eV:	-9.3(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(ethylamino)-1-oxopropan-2-yl] (2R)-2-phenoxypropanoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)OCC(=O)NC1=CC=CC=C1SCC(=O)N)OC2=CC=CC=C2

DOS

IR

Vibrations