Geometry & MOs

Info

ID:	251260
PubChem CID:	103102521
Reduced:	S2N3O3C11H15 (1)
Stoich.:	A2B3C3D11E15 (1)
Weight, g/mol:	335.016511
ΔH_f, kcal/mol:	-91.76
Dipole, Da:	5.55
IP(EA), eV:	-8.96(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-carbamothioyl-2-chlorophenyl)sulfonyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)S(=O)(=O)C1=CC=CC=C1C(=S)N

DOS

IR

Vibrations