Geometry & MOs

Info

ID:	280228
PubChem CID:	103847870
Reduced:	O2S2N3C8H11 (1)
Stoich.:	A2B2C3D8E11 (1)
Weight, g/mol:	278.039499
ΔH_f, kcal/mol:	-20.66
Dipole, Da:	8.33
IP(EA), eV:	-10.04(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[ethyl-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]amino]acetate

Drug info:

PubChemData

Smile

CCN(CC#N)S(=O)(=O)C1=CN=C(S1)C

DOS

IR

Vibrations