Geometry & MOs

Info

ID:	280557
PubChem CID:	103849895
Reduced:	SO2N3C11H11 (1)
Stoich.:	AB2C3D11E11 (1)
Weight, g/mol:	231.013619
ΔH_f, kcal/mol:	-2.51
Dipole, Da:	1.12
IP(EA), eV:	-10.56(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanoethyl)-2-methyl-1,3-thiazole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C#N)S(=O)(=O)NC(C)C#N

DOS

IR

Vibrations