Geometry & MOs

Info

ID:	343185
PubChem CID:	127266358
Reduced:	ClSN3O4C12H16 (1)
Stoich.:	ABC3D4E12F16 (1)
Weight, g/mol:	346.086639
ΔH_f, kcal/mol:	-150.45
Dipole, Da:	9.89
IP(EA), eV:	-8.39(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-chloro-2-(dimethylamino)phenyl]carbamoylamino]-N-[dimethyl(oxo)-lambda6-sulfanylidene]acetamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)Cl)NC(=O)NCC(=O)N=S(=O)(C)C

DOS

IR

Vibrations