Geometry & MOs

Info

ID:	124821
PubChem CID:	50897350
Reduced:	Fe2N2P2O7C25H36 (1)
Stoich.:	A2B2C2D7E25F36 (1)
Weight, g/mol:	483.00897
ΔH_f, kcal/mol:	244.26
Dipole, Da:	6.31
IP(EA), eV:	-6.62(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

carbon monoxide;(4,7-dimethyl-6-oxonio-1,3-benzodioxol-5-yl)oxidanium;rhenium

Drug info:

PubChemData

Smile

CC1(CCCC(N1[P-]C(=O)[P-]N2C(CCCC2(C)C)(C)C)(C)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe]

DOS

IR

Vibrations