Geometry & MOs

Info

ID:	125112
PubChem CID:	50910304
Reduced:	CuN2O4C6H13 (2)
Stoich.:	AB2C4D6E13 (2)
Weight, g/mol:	679.14199
ΔH_f, kcal/mol:	37.03
Dipole, Da:	7.2
IP(EA), eV:	-3.23(-3.11)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

copper;5,10,15,20-tetrapyridin-4-ylporphyrin-22,24-diide

Drug info:

PubChemData

Smile

C(C[NH2+]C(=[OH+])C(=[OH+])[NH2+]CCC[NH2+]C(=O)C(=O)[OH2+])C[NH2+]C(=O)C(=O)[OH2+].[Cu+2].[Cu+2]

DOS

IR

Vibrations