Geometry & MOs

Info

ID:	66594
PubChem CID:	46504869
Reduced:	SBr2N2O3H16C17 (1)
Stoich.:	AB2C2D3E16F17 (1)
Weight, g/mol:	417.07218
ΔH_f, kcal/mol:	-66.19
Dipole, Da:	10.39
IP(EA), eV:	-8.67(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[3-(dimethylamino)propyl]-1-propanoyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)NC3=CC=C(C=C3)Br)Br

DOS

IR

Vibrations