Geometry & MOs

Info

ID:	8737
PubChem CID:	80850
Reduced:	ClSN2O4H11C13 (1)
Stoich.:	ABC2D4E11F13 (1)
Weight, g/mol:	326.012806
ΔH_f, kcal/mol:	-33.92
Dipole, Da:	4.31
IP(EA), eV:	-9.01(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-methyl-3-nitro-N-phenylbenzenesulfonamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

DOS

IR

Vibrations