Geometry & MOs

Info

ID:	250978
PubChem CID:	103100550
Reduced:	ClS2O3N4C11H13 (1)
Stoich.:	AB2C3D4E11F13 (1)
Weight, g/mol:	339.036578
ΔH_f, kcal/mol:	-44.35
Dipole, Da:	2.7
IP(EA), eV:	-9.48(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(5-chloro-4-methylthiophen-2-yl)sulfonylamino]-4-methylpentanoate

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NC2=NN=C(O2)C3CCCN3)Cl

DOS

IR

Vibrations