Geometry & MOs

Info

ID:	153184
PubChem CID:	56312336
Reduced:	SN4O5C24H30 (1)
Stoich.:	AB4C5D24E30 (1)
Weight, g/mol:	472.178041
ΔH_f, kcal/mol:	-163.6
Dipole, Da:	9.2
IP(EA), eV:	-8.67(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[3-methyl-4-[2-oxo-2-(5-sulfamoyl-2,3-dihydroindol-1-yl)ethyl]piperazin-1-yl]benzoate

Drug info:

PubChemData

Smile

CC1CC2=C(N1C(=O)CN3CCN(CC3C)C4=CC=C(C=C4)C(=O)OC)C=CC(=C2)S(=O)(=O)N

DOS

IR

Vibrations