Geometry & MOs

Info

ID:	272894
PubChem CID:	103764141
Reduced:	FN3O3H12C14 (1)
Stoich.:	AB3C3D12E14 (1)
Weight, g/mol:	346.99238
ΔH_f, kcal/mol:	-129.5
Dipole, Da:	4.2
IP(EA), eV:	-9.73(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(2-bromo-4-chlorobenzoyl)-ethylamino]acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1F)C(=O)N)NC(=O)C2=CC(=O)NC=C2

DOS

IR

Vibrations