Geometry & MOs

Info

ID:	125095
PubChem CID:	50909707
Reduced:	CoSO2N4C14H17 (1)
Stoich.:	ABC2D4E14F17 (1)
Weight, g/mol:	341.073539
ΔH_f, kcal/mol:	-22.74
Dipole, Da:	26.11
IP(EA), eV:	-10.49(-5.91)
Spin(S_z, S²):	None, None
Charge, e:	3

Chem-info

IUPAC name:

copper;[C-(4-methylpiperazin-1-yl)-N-(1-pyridin-2-ylethylideneamino)carbonimidoyl]sulfanium

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1[OH2+])C=NNC(=S)N.C1=CC=NC=C1.[Co+2]

DOS

IR

Vibrations