Geometry & MOs

Info

ID:	283073
PubChem CID:	103956603
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	278.072513
ΔH_f, kcal/mol:	-106.8
Dipole, Da:	4.59
IP(EA), eV:	-9.09(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dihydroxy-N-(4-propan-2-yl-1,3-thiazol-2-yl)benzamide

Drug info:

PubChemData

Smile

CCCCCN(C(C)C)C(=O)C1=CC(=C(C=C1)O)C

DOS

IR

Vibrations