Geometry & MOs

Info

ID:	354624
PubChem CID:	127287241
Reduced:	SO4N5C16H31 (1)
Stoich.:	AB4C5D16E31 (1)
Weight, g/mol:	318.216809
ΔH_f, kcal/mol:	-146.29
Dipole, Da:	4.92
IP(EA), eV:	-8.82(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclopropyl(methyl)amino]propyl]-4-pyrazin-2-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)N1CCN(CC1)S(=O)(=O)N2CCOCC2)N(C)C3CC3

DOS

IR

Vibrations