Geometry & MOs

Info

ID:	347985
PubChem CID:	127273047
Reduced:	SO4N5C16H29 (1)
Stoich.:	AB4C5D16E29 (1)
Weight, g/mol:	380.188212
ΔH_f, kcal/mol:	-132.88
Dipole, Da:	3.53
IP(EA), eV:	-8.07(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[2-(4-methylpiperazin-1-yl)propyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)S(=O)(=O)N[C@@H](C)C(=O)NCC(C)N2CCN(CC2)C

DOS

IR

Vibrations