Geometry & MOs

Info

ID:	79424
PubChem CID:	49748546
Reduced:	ClSN3O4H22C26 (1)
Stoich.:	ABC3D4E22F26 (1)
Weight, g/mol:	518.01611
ΔH_f, kcal/mol:	-44.25
Dipole, Da:	5.12
IP(EA), eV:	-8.32(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-6-yl]-2-iodobenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C5=CC=CC=C5

DOS

IR

Vibrations