Geometry & MOs

Info

ID:	356595
PubChem CID:	127291821
Reduced:	O3N4C19H34 (1)
Stoich.:	A3B4C19D34 (1)
Weight, g/mol:	333.172228
ΔH_f, kcal/mol:	-155.86
Dipole, Da:	3.18
IP(EA), eV:	-9.05(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,1-dioxo-1,2-thiazolidin-2-yl)-1-[4-(2-hydroxybutyl)piperazin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CCC(CN1CCN(CC1)C(=O)C2CCCN(C2)C(=O)N3CCCC3)O

DOS

IR

Vibrations