Geometry & MOs

Info

ID:	348683
PubChem CID:	127273794
Reduced:	SO4N5C14H23 (1)
Stoich.:	AB4C5D14E23 (1)
Weight, g/mol:	398.141262
ΔH_f, kcal/mol:	-130.92
Dipole, Da:	8.39
IP(EA), eV:	-9.12(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1,2-dimethylimidazol-4-yl)sulfonylpiperazin-1-yl]-naphthalen-2-ylmethanone

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)N2CCN(CC2)C(=O)N3CCOCC3

DOS

IR

Vibrations