Geometry & MOs

Info

ID:	195306
PubChem CID:	78671341
Reduced:	Cl2N2O3C19H22 (1)
Stoich.:	A2B2C3D19E22 (1)
Weight, g/mol:	383.184506
ΔH_f, kcal/mol:	-104.45
Dipole, Da:	2.49
IP(EA), eV:	-7.92(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[N-[[4-(diethylamino)benzoyl]amino]-C-methylcarbonimidoyl]phenoxy]acetic acid

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)NC(C)C(=O)NC2=C(C=C(C=C2)Cl)Cl)OCC

DOS

IR

Vibrations