Geometry & MOs

Info

ID:	21901
PubChem CID:	593307
Reduced:	NSO3H19C24 (1)
Stoich.:	ABC3D19E24 (1)
Weight, g/mol:	401.108565
ΔH_f, kcal/mol:	-23.42
Dipole, Da:	5.5
IP(EA), eV:	-8.85(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(benzenesulfonyl)-N-benzylnaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN(C(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations