Geometry & MOs

Info

ID:	350466
PubChem CID:	127277828
Reduced:	SO2N3C21H31 (1)
Stoich.:	AB2C3D21E31 (1)
Weight, g/mol:	299.166748
ΔH_f, kcal/mol:	-81.86
Dipole, Da:	8.78
IP(EA), eV:	-8.87(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-piperidin-1-ylethyl)-3-propanoyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)NCC2=CC=C(C=C2)CN3CCCCC3C

DOS

IR

Vibrations