Geometry & MOs

Info

ID:	158154
PubChem CID:	56463072
Reduced:	S2N3O4C18H19 (1)
Stoich.:	A2B3C4D18E19 (1)
Weight, g/mol:	447.161663
ΔH_f, kcal/mol:	-80.66
Dipole, Da:	6.34
IP(EA), eV:	-9.05(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-N-methyl-N-[1-(3-sulfamoylphenyl)ethyl]indole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)S(=O)(=O)N)N(C)C(=O)CSC2=NC3=CC=CC=C3O2

DOS

IR

Vibrations