Geometry & MOs

Info

ID:	131784
PubChem CID:	51260698
Reduced:	O2S2N4H14C15 (1)
Stoich.:	A2B2C4D14E15 (1)
Weight, g/mol:	295.135448
ΔH_f, kcal/mol:	43.75
Dipole, Da:	6.54
IP(EA), eV:	-9.02(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[4-cyanobutyl(methyl)amino]ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)NCC2=NC(=NO2)C3=CSC=C3)SCC(=O)N

DOS

IR

Vibrations