Geometry & MOs

Info

ID:	193159
PubChem CID:	78351418
Reduced:	ClSN4O5C24H27 (1)
Stoich.:	ABC4D5E24F27 (1)
Weight, g/mol:	455.164555
ΔH_f, kcal/mol:	-137.67
Dipole, Da:	2.36
IP(EA), eV:	-8.89(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4-chlorophenyl)-methylsulfamoyl]-N,N-diethyl-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CN(C1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC3=C(C=C2)N=CC(C3=O)C(=O)NCCCN4CCOCC4

DOS

IR

Vibrations