Geometry & MOs

Info

ID:	122309
PubChem CID:	50801836
Reduced:	SO3N4C22H34 (1)
Stoich.:	AB3C4D22E34 (1)
Weight, g/mol:	433.12269
ΔH_f, kcal/mol:	-111.44
Dipole, Da:	3.84
IP(EA), eV:	-8.79(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)methyl]-5-(diethylsulfamoyl)-1-methylindole-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=C2)C(=O)NCCC(C)N3CCCC3)C

DOS

IR

Vibrations