Geometry & MOs

Info

ID:	277698
PubChem CID:	103830445
Reduced:	BrNO4C15H18 (1)
Stoich.:	ABC4D15E18 (1)
Weight, g/mol:	339.98811
ΔH_f, kcal/mol:	-161.11
Dipole, Da:	4.43
IP(EA), eV:	-9.44(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-hydroxy-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=C(C=C2)Br)O

DOS

IR

Vibrations