Geometry & MOs

Info

ID:	76944
PubChem CID:	48425609
Reduced:	SO3N4C15H24 (1)
Stoich.:	AB3C4D15E24 (1)
Weight, g/mol:	388.145678
ΔH_f, kcal/mol:	-134.9
Dipole, Da:	4.47
IP(EA), eV:	-8.89(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(benzenesulfonylmethyl)-N-[2-(diethylamino)-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CC1=CSC(=N1)NC(=O)C(C)C

DOS

IR

Vibrations