Geometry & MOs

Info

ID:	329945
PubChem CID:	127246932
Reduced:	SO3N5C13H21 (1)
Stoich.:	AB3C5D13E21 (1)
Weight, g/mol:	332.130697
ΔH_f, kcal/mol:	-78.56
Dipole, Da:	3.07
IP(EA), eV:	-8.96(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1-benzylsulfonylpyrrolidin-2-yl)-N-methylpyrazin-2-amine

Drug info:

PubChemData

Smile

CNC1=NC(=CN=C1)C2CCCN2S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations