Geometry & MOs

Info

ID:	277700
PubChem CID:	103830462
Reduced:	BrSO2N3H6C9 (1)
Stoich.:	ABC2D3E6F9 (1)
Weight, g/mol:	308.98007
ΔH_f, kcal/mol:	9.31
Dipole, Da:	7.01
IP(EA), eV:	-9.85(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(=O)NC2=NN=CS2)O)Br

DOS

IR

Vibrations