Geometry & MOs

Info

ID:	29516
PubChem CID:	834639
Reduced:	BrNSC14H14 (1)
Stoich.:	ABCD14E14 (1)
Weight, g/mol:	308.06532
ΔH_f, kcal/mol:	48.49
Dipole, Da:	3.33
IP(EA), eV:	-8.53(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-methylsulfanylphenyl)methylamino]benzenesulfonamide

Drug info:

PubChemData

Smile

CSC1=CC=C(C=C1)CNC2=CC=C(C=C2)Br

DOS

IR

Vibrations