Geometry & MOs

Info

ID:	138295
PubChem CID:	52342331
Reduced:	FS2N4H13C17 (1)
Stoich.:	AB2C4D13E17 (1)
Weight, g/mol:	349.109627
ΔH_f, kcal/mol:	89.38
Dipole, Da:	6.86
IP(EA), eV:	-8.54(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-[(3-methyl-4-nitroanilino)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CN(CC2=C1SC=C2)C3=NN4C=C(N=C4S3)C5=CC=C(C=C5)F

DOS

IR

Vibrations