Geometry & MOs

Info

ID:	409696
PubChem CID:	135082479
Reduced:	ClS2N3H10C14 (1)
Stoich.:	AB2C3D10E14 (1)
Weight, g/mol:	460.156097
ΔH_f, kcal/mol:	110.99
Dipole, Da:	5.7
IP(EA), eV:	-9.57(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

cobalt;(6Z)-6-[[3-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]propylamino]methylidene]cyclohexa-2,4-dien-1-one;propylbenzene

Drug info:

PubChemData

Smile

C1/C(=C(/C#N)\N2C=CN=C2)/SC(S1)C3=CC=CC=C3Cl

DOS

IR

Vibrations