Geometry & MOs

Info

ID:	6390
PubChem CID:	68389
Reduced:	NO3H9C10 (1)
Stoich.:	AB3C9D10 (1)
Weight, g/mol:	191.058243
ΔH_f, kcal/mol:	-81.52
Dipole, Da:	2.76
IP(EA), eV:	-9.2(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-anilino-4-oxobut-2-enoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)C=CC(=O)O

DOS

IR

Vibrations