Geometry & MOs

Info

ID:	271655
PubChem CID:	103687681
Reduced:	BrNSO3H12C13 (1)
Stoich.:	ABCD3E12F13 (1)
Weight, g/mol:	278.072513
ΔH_f, kcal/mol:	-73.04
Dipole, Da:	2.75
IP(EA), eV:	-8.7(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2,5-dihydroxybenzamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=CS1)Br)C(=O)C2=C(C=CC(=C2)O)O

DOS

IR

Vibrations