Geometry & MOs

Info

ID:	66638
PubChem CID:	46504966
Reduced:	BrSN3O5H16C18 (1)
Stoich.:	ABC3D5E16F18 (1)
Weight, g/mol:	464.04054
ΔH_f, kcal/mol:	-53.52
Dipole, Da:	12.26
IP(EA), eV:	-9.11(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1-(cyclopropanecarbonyl)-N-(4-ethoxyphenyl)-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

C1CC1C(=O)N2CCC3=CC(=C(C=C32)S(=O)(=O)NC4=CC(=CC=C4)[N+](=O)[O-])Br

DOS

IR

Vibrations