Geometry & MOs

Info

ID:	195941
PubChem CID:	78751748
Reduced:	ClFN2O3H12C18 (1)
Stoich.:	ABC2D3E12F18 (1)
Weight, g/mol:	410.043627
ΔH_f, kcal/mol:	-68.77
Dipole, Da:	5.48
IP(EA), eV:	-9.22(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3,5-dichloroanilino)-1-oxopropan-2-yl] 4-(2-amino-2-oxoethoxy)benzoate

Drug info:

PubChemData

Smile

C1=CC2=NC(=C(N2C=C1)C=CC(=O)OCC(=O)C3=CC(=CC=C3)F)Cl

DOS

IR

Vibrations