iron;bis(iron(3+));tris(oxygen(2-))

Fe4O3 — CID 173005806

IUPACiron;bis(iron(3+));tris(oxygen(2-))
SMILES[Fe+3].[Fe+3].[Fe].[Fe].[O-2].[O-2].[O-2]
InChIInChI=1S/4Fe.3O/q;;2*+3;3*-2
InChIKeyPNOBMQRRXUBRBE-UHFFFAOYSA-N
MW271.38 g/mol
LogP-0.37
Rot. Bonds

About iron;bis(iron(3+));tris(oxygen(2-))

iron;bis(iron(3+));tris(oxygen(2-)) (PubChem CID 173005806) has the molecular formula Fe4O3 and a molecular weight of 271.38 g/mol. Its IUPAC name is iron;bis(iron(3+));tris(oxygen(2-)).

Molecular Properties

Compound Nameiron;bis(iron(3+));tris(oxygen(2-))
PubChem CID173005806
Molecular FormulaFe4O3
Molecular Weight271.38 g/mol
Exact Mass271.72
IUPAC Nameiron;bis(iron(3+));tris(oxygen(2-))
SMILES[Fe+3].[Fe+3].[Fe].[Fe].[O-2].[O-2].[O-2]
InChIInChI=1S/4Fe.3O/q;;2*+3;3*-2
InChIKeyPNOBMQRRXUBRBE-UHFFFAOYSA-N
XLogP-0.37
TPSA85.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.38
LogP ≤ 5-0.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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CID 159215823
iron(3+);tris(oxygen(2-));titanium(3+)
CID 159465435
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CID 173360659
distrontium;bis(iron(3+));nonakis(oxygen(2-));bis(titanium(4+))
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Frequently Asked Questions

What is the IUPAC name of iron;bis(iron(3+));tris(oxygen(2-))?
The IUPAC name of iron;bis(iron(3+));tris(oxygen(2-)) (CID 173005806) is iron;bis(iron(3+));tris(oxygen(2-)).
What is the SMILES notation for iron;bis(iron(3+));tris(oxygen(2-))?
The canonical SMILES for iron;bis(iron(3+));tris(oxygen(2-)) is [Fe+3].[Fe+3].[Fe].[Fe].[O-2].[O-2].[O-2].
What is the InChIKey of iron;bis(iron(3+));tris(oxygen(2-))?
The InChIKey is PNOBMQRRXUBRBE-UHFFFAOYSA-N. The full InChI is InChI=1S/4Fe.3O/q;;2*+3;3*-2.
What are the key properties of iron;bis(iron(3+));tris(oxygen(2-))?
iron;bis(iron(3+));tris(oxygen(2-)) has a molecular weight of 271.38 g/mol, XLogP of -0.37, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iron;bis(iron(3+));tris(oxygen(2-)) is sourced from PubChem (CID 173005806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).