Geometry & MOs

Info

ID:	309713
PubChem CID:	126555828
Reduced:	OSN7C19H29 (1)
Stoich.:	ABC7D19E29 (1)
Weight, g/mol:	368.108916
ΔH_f, kcal/mol:	52.03
Dipole, Da:	3.09
IP(EA), eV:	-8.48(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2,3-dihydro-1,5-naphthyridin-4-yl)-4-methylsulfonylpiperazine-1-carbothiohydrazide

Drug info:

PubChemData

Smile

C1CN=C2C=CC=NC2=C1NNC(=S)N3CCN(CC3)CCN4CCOCC4

DOS

IR

Vibrations