Geometry & MOs

Info

ID:	66736
PubChem CID:	46505165
Reduced:	BrClSN2O4C18H18 (1)
Stoich.:	ABCD2E4F18G18 (1)
Weight, g/mol:	452.04054
ΔH_f, kcal/mol:	-127.37
Dipole, Da:	7.94
IP(EA), eV:	-8.4(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-5-bromo-N-(2-ethoxyphenyl)-2-methyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CC1CC2=CC(=C(C=C2N1C(=O)C)S(=O)(=O)NC3=C(C=CC(=C3)Cl)OC)Br

DOS

IR

Vibrations