Geometry & MOs

Info

ID:	346120
PubChem CID:	127270608
Reduced:	SO2N4C13H18 (1)
Stoich.:	AB2C4D13E18 (1)
Weight, g/mol:	317.185175
ΔH_f, kcal/mol:	-63.64
Dipole, Da:	3.82
IP(EA), eV:	-8.76(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-ylcarbamoylamino)-N-pyridin-3-ylacetamide

Drug info:

PubChemData

Smile

C1CSCCC1NC(=O)NCC(=O)NC2=CN=CC=C2

DOS

IR

Vibrations