Geometry & MOs

Info

ID:	66587
PubChem CID:	46504861
Reduced:	BrSN3O4C22H24 (1)
Stoich.:	ABC3D4E22F24 (1)
Weight, g/mol:	422.02998
ΔH_f, kcal/mol:	-121.97
Dipole, Da:	11.9
IP(EA), eV:	-8.71(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-5-bromo-1-propanoyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4)Br

DOS

IR

Vibrations