Geometry & MOs

Info

ID:	238701
PubChem CID:	92765100
Reduced:	SN5O5C23H35 (1)
Stoich.:	AB5C5D23E35 (1)
Weight, g/mol:	479.256626
ΔH_f, kcal/mol:	-191.16
Dipole, Da:	4.34
IP(EA), eV:	-8.55(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCNC(=O)[C@H]2CC3=C(N2C(=O)C)C=CC(=C3)S(=O)(=O)N4CCOCC4

DOS

IR

Vibrations