Geometry & MOs

Info

ID:	277716
PubChem CID:	103830548
Reduced:	BrN2O2H13C14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	353.00628
ΔH_f, kcal/mol:	-34.72
Dipole, Da:	4.55
IP(EA), eV:	-9.37(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(4-ethoxy-3-fluorophenyl)-3-hydroxybenzamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)CNC(=O)C2=CC(=C(C=C2)Br)O

DOS

IR

Vibrations