Geometry & MOs

Info

ID:	63318
PubChem CID:	26750592
Reduced:	NO4C19H21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	341.126323
ΔH_f, kcal/mol:	-133.98
Dipole, Da:	5.54
IP(EA), eV:	-9.34(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(2-acetylanilino)-1-oxopropan-2-yl] 3-methoxybenzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)[C@H](C)OC(=O)C2=CC(=CC=C2)OC

DOS

IR

Vibrations