Geometry & MOs

Info

ID:	238704
PubChem CID:	92765106
Reduced:	SO4N5C24H39 (1)
Stoich.:	AB4C5D24E39 (1)
Weight, g/mol:	465.240976
ΔH_f, kcal/mol:	-168.74
Dipole, Da:	3.26
IP(EA), eV:	-8.27(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-acetyl-5-(diethylsulfamoyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCCNC(=O)[C@H]2CC3=C(N2C(=O)C)C=CC(=C3)S(=O)(=O)N(CC)CC

DOS

IR

Vibrations