Geometry & MOs

Info

ID:	350470
PubChem CID:	127277832
Reduced:	SN3O3C14H25 (1)
Stoich.:	AB3C3D14E25 (1)
Weight, g/mol:	311.166748
ΔH_f, kcal/mol:	-141.08
Dipole, Da:	3.94
IP(EA), eV:	-8.77(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)NC(C)CN2CCOCC2

DOS

IR

Vibrations