Geometry & MOs

Info

ID:	18132
PubChem CID:	538439
Reduced:	SN3O5C16H17 (1)
Stoich.:	AB3C5D16E17 (1)
Weight, g/mol:	363.088892
ΔH_f, kcal/mol:	-91.74
Dipole, Da:	7.88
IP(EA), eV:	-8.98(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[4-[(4-methylphenyl)sulfonylamino]-3-nitrophenyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)N(C)C(=O)C)[N+](=O)[O-]

DOS

IR

Vibrations