Geometry & MOs

Info

ID:	168387
PubChem CID:	74960103
Reduced:	PtN2O4C16H20 (1)
Stoich.:	AB2C4D16E20 (1)
Weight, g/mol:	489.122752
ΔH_f, kcal/mol:	100.63
Dipole, Da:	14.1
IP(EA), eV:	-9.37(-3.6)
Spin(S_z, S²):	None, None
Charge, e:	4

Chem-info

IUPAC name:

cyclohexane-1,2-diamine;3-(3,4-dihydroxyphenyl)prop-2-enoic acid;platinum(4+)

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C=CC(=O)[O-])[O-].C1CCC(C(C1)[NH-])[NH-].[Pt+4]

DOS

IR

Vibrations