Geometry & MOs

Info

ID:	30060
PubChem CID:	839384
Reduced:	NO4C20H23 (1)
Stoich.:	AB4C20D23 (1)
Weight, g/mol:	329.089937
ΔH_f, kcal/mol:	-153.69
Dipole, Da:	1.32
IP(EA), eV:	-9.0(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-acetyloxy-3-methoxybenzoyl)amino]benzoic acid

Drug info:

PubChemData

Smile

CC[C@H](C)C1=CC=CC=C1OCC(=O)NC2=C(C=C(C=C2)C)C(=O)O

DOS

IR

Vibrations