Geometry & MOs

Info

ID:	66692
PubChem CID:	46505071
Reduced:	BrSN3O3C19H28 (1)
Stoich.:	ABC3D3E19F28 (1)
Weight, g/mol:	469.10348
ΔH_f, kcal/mol:	-88.72
Dipole, Da:	9.97
IP(EA), eV:	-8.62(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCN(C)CCNS(=O)(=O)C1=C(C=C2CCN(C2=C1)C(=O)C3CC3)Br

DOS

IR

Vibrations