Geometry & MOs

Info

ID:	240936
PubChem CID:	93618282
Reduced:	SO2N3C18H23 (1)
Stoich.:	AB2C3D18E23 (1)
Weight, g/mol:	278.145285
ΔH_f, kcal/mol:	-68.46
Dipole, Da:	3.65
IP(EA), eV:	-8.6(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-3-thiophen-3-ylpropanamide

Drug info:

PubChemData

Smile

C1CCN2CC[C@@H]([C@H]2C1)NC(=O)CN3C(=O)CSC4=CC=CC=C43

DOS

IR

Vibrations