Geometry & MOs

Info

ID:	293613
PubChem CID:	117394406
Reduced:	SO4C12H16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	256.088164
ΔH_f, kcal/mol:	-161.23
Dipole, Da:	7.15
IP(EA), eV:	-8.76(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[4-[2-(methylamino)acetyl]phenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1SC)C(C(=O)O)O)OC

DOS

IR

Vibrations