Geometry & MOs

Info

ID:	35691
PubChem CID:	7980209
Reduced:	NO5C19H19 (1)
Stoich.:	AB5C19D19 (1)
Weight, g/mol:	391.141973
ΔH_f, kcal/mol:	-160.25
Dipole, Da:	5.83
IP(EA), eV:	-9.22(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC=C(C=C1)C(=O)C)OC(=O)COC2=CC=CC=C2

DOS

IR

Vibrations