Geometry & MOs

Info

ID:	201389
PubChem CID:	79532107
Reduced:	BrF3N3H9C12 (1)
Stoich.:	AB3C3D9E12 (1)
Weight, g/mol:	275.095771
ΔH_f, kcal/mol:	-101.97
Dipole, Da:	4.34
IP(EA), eV:	-8.4(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)NC2=C(C=C(C=N2)N)Br)C(F)(F)F

DOS

IR

Vibrations