Geometry & MOs

Info

ID:	22330
PubChem CID:	596734
Reduced:	NO5H15C16 (1)
Stoich.:	AB5C15D16 (1)
Weight, g/mol:	301.095023
ΔH_f, kcal/mol:	-174.13
Dipole, Da:	2.21
IP(EA), eV:	-9.1(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(3,4-dihydroxybenzoyl)amino]benzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)O)O

DOS

IR

Vibrations