Geometry & MOs

Info

ID:	240713
PubChem CID:	93617169
Reduced:	SO2N4C16H22 (1)
Stoich.:	AB2C4D16E22 (1)
Weight, g/mol:	299.130363
ΔH_f, kcal/mol:	-15.71
Dipole, Da:	7.16
IP(EA), eV:	-8.82(-0.05)
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]-3,5-dimethyl-1,2-oxazole-4-sulfonamide

Drug info:

PubChemData

Smile

C[C@H](CNS(=O)(=O)C1=CN(N=C1)C)N2CCC3=CC=CC=C3C2

DOS

IR

Vibrations