Geometry & MOs

Info

ID:	66654
PubChem CID:	46505005
Reduced:	BrSN2O5C19H23 (1)
Stoich.:	ABC2D5E19F23 (1)
Weight, g/mol:	455.08783
ΔH_f, kcal/mol:	-165.5
Dipole, Da:	7.78
IP(EA), eV:	-8.47(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1-(cyclopropanecarbonyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

C1CC1C(=O)N2CCC3=CC(=C(C=C32)S(=O)(=O)N4CCC5(CC4)OCCO5)Br

DOS

IR

Vibrations