Geometry & MOs

Info

ID:	257247
PubChem CID:	103144630
Reduced:	BrFON2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	334.03169
ΔH_f, kcal/mol:	-56.48
Dipole, Da:	4.11
IP(EA), eV:	-7.97(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,5-dimethylphenyl)-4-bromo-2-hydroxybenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NC(=O)C2=C(C=CC(=C2)F)Br)C)N

DOS

IR

Vibrations