Geometry & MOs

Info

ID:	345200
PubChem CID:	127268960
Reduced:	SO2N5C16H23 (1)
Stoich.:	AB2C5D16E23 (1)
Weight, g/mol:	397.219927
ΔH_f, kcal/mol:	6.42
Dipole, Da:	6.36
IP(EA), eV:	-9.86(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexyl-N-[1-[5-fluoro-2-(4-methylpiperazin-1-yl)phenyl]ethyl]methanesulfonamide

Drug info:

PubChemData

Smile

CN(CCC1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)N3C=NN=N3

DOS

IR

Vibrations