Geometry & MOs

Info

ID:	350387
PubChem CID:	127277727
Reduced:	SN3O3C16H29 (1)
Stoich.:	AB3C3D16E29 (1)
Weight, g/mol:	336.114378
ΔH_f, kcal/mol:	-148.69
Dipole, Da:	2.85
IP(EA), eV:	-8.66(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-propanoyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)NCC(C(C)C)N2CCOCC2

DOS

IR

Vibrations