Geometry & MOs

Info

ID:	200332
PubChem CID:	79376453
Reduced:	SO2N3C11H17 (1)
Stoich.:	AB2C3D11E17 (1)
Weight, g/mol:	286.146347
ΔH_f, kcal/mol:	-68.0
Dipole, Da:	6.24
IP(EA), eV:	-9.32(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(1-ethylimidazol-4-yl)sulfonylpyrrolidin-2-yl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(=O)CNC1=C(C(=NS1)C)C(=O)C

DOS

IR

Vibrations