Geometry & MOs

Info

ID:	65004
PubChem CID:	29204321
Reduced:	OSN2Cl3H13C15 (1)
Stoich.:	ABC2D3E13F15 (1)
Weight, g/mol:	431.002881
ΔH_f, kcal/mol:	-0.74
Dipole, Da:	2.44
IP(EA), eV:	-8.76(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-[2-[(2,4,6-trichloroanilino)carbamoyl]phenyl]sulfanylacetamide

Drug info:

PubChemData

Smile

CSCC1=CC(=CC=C1)C(=O)NNC2=C(C=C(C=C2Cl)Cl)Cl

DOS

IR

Vibrations