Geometry & MOs

Info

ID:	35689
PubChem CID:	7980207
Reduced:	NO4H23C24 (1)
Stoich.:	AB4C23D24 (1)
Weight, g/mol:	341.126323
ΔH_f, kcal/mol:	-99.1
Dipole, Da:	3.18
IP(EA), eV:	-8.73(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(4-acetylanilino)-1-oxopropan-2-yl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C2=CC=CC=C2)OC(=O)COC3=CC=CC=C3

DOS

IR

Vibrations