Geometry & MOs

Info

ID:	27880
PubChem CID:	824014
Reduced:	FN2O2H15C17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	315.074287
ΔH_f, kcal/mol:	-83.35
Dipole, Da:	4.28
IP(EA), eV:	-8.74(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-acetamidophenoxy)phthalic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N[C@@H]2CC(=O)N(C2=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations