Geometry & MOs

Info

ID:	240714
PubChem CID:	93617171
Reduced:	SN3O3C13H21 (1)
Stoich.:	AB3C3D13E21 (1)
Weight, g/mol:	326.141262
ΔH_f, kcal/mol:	-88.41
Dipole, Da:	3.3
IP(EA), eV:	-8.74(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(1R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]sulfamoyl]-1-methylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)S(=O)(=O)N[C@H]2CCN3[C@@H]2CCCC3

DOS

IR

Vibrations