Geometry & MOs

Info

ID:	66582
PubChem CID:	46504851
Reduced:	BrSN2O5C18H27 (1)
Stoich.:	ABC2D5E18F27 (1)
Weight, g/mol:	496.06676
ΔH_f, kcal/mol:	-202.6
Dipole, Da:	7.13
IP(EA), eV:	-8.99(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(2,5-diethoxyphenyl)-1-propanoyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)NCCC(OCC)OCC)Br

DOS

IR

Vibrations