Geometry & MOs

Info

ID:	277695
PubChem CID:	103830436
Reduced:	BrSN2O2H9C14 (1)
Stoich.:	ABC2D2E9F14 (1)
Weight, g/mol:	336.97721
ΔH_f, kcal/mol:	-6.84
Dipole, Da:	1.41
IP(EA), eV:	-8.9(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-hydroxy-N-(4-methylsulfanylphenyl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)Br)O

DOS

IR

Vibrations