Geometry & MOs

Info

ID:	350493
PubChem CID:	127277855
Reduced:	SO3N4C19H32 (1)
Stoich.:	AB3C4D19E32 (1)
Weight, g/mol:	354.118418
ΔH_f, kcal/mol:	-164.43
Dipole, Da:	6.09
IP(EA), eV:	-9.24(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-(1,3-thiazol-4-ylmethyl)piperazine-1-carbonyl]-1,3-thiazolidin-3-yl]propan-1-one

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)N2CCC(CC2)NC(=O)NC3CCCCC3

DOS

IR

Vibrations