Geometry & MOs

Info

ID:	268894
PubChem CID:	103601988
Reduced:	ClFNO3H13C14 (1)
Stoich.:	ABCD3E13F14 (1)
Weight, g/mol:	328.04226
ΔH_f, kcal/mol:	-109.6
Dipole, Da:	2.98
IP(EA), eV:	-9.04(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-2-hydroxybenzamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=CC=C(O2)Cl

DOS

IR

Vibrations