Geometry & MOs

Info

ID:	364938
PubChem CID:	127316586
Reduced:	OS2N5C17H23 (1)
Stoich.:	AB2C5D17E23 (1)
Weight, g/mol:	315.161663
ΔH_f, kcal/mol:	44.12
Dipole, Da:	3.08
IP(EA), eV:	-8.65(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-cyclobutylpiperazin-1-yl)-3-(1,1-dioxo-1,2-thiazolidin-2-yl)propan-1-one

Drug info:

PubChemData

Smile

CN1C(=NN=C1SCC(=O)N2CCN(CC2)C3CCC3)C4=CC=CS4

DOS

IR

Vibrations