Geometry & MOs

Info

ID:	198993
PubChem CID:	79185577
Reduced:	N2O2S2C15H24 (1)
Stoich.:	A2B2C2D15E24 (1)
Weight, g/mol:	226.041213
ΔH_f, kcal/mol:	-71.75
Dipole, Da:	3.26
IP(EA), eV:	-8.88(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyanomethyl)-N-methoxybenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C(C)(C)C)N(C)S(=O)(=O)C1=CC=C(C=C1)CC(=S)N

DOS

IR

Vibrations