About tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate
tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate (PubChem CID 173269238) has the molecular formula Fe3O40P10Pb3V3-15
and a molecular weight of 1891.67 g/mol. Its IUPAC name is tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate.
Molecular Properties
| Compound Name | tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate |
|---|
| PubChem CID | 173269238 |
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| Molecular Formula | Fe3O40P10Pb3V3-15 |
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| Molecular Weight | 1891.67 g/mol |
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| Exact Mass | 1894.11 |
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| IUPAC Name | tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate |
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| SMILES | O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Fe+3].[Fe+3].[Fe+3].[Pb+2].[Pb+2].[Pb+2].[V].[V].[V] |
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| InChI | InChI=1S/3Fe.10H3O4P.3Pb.3V/c;;;10*1-5(2,3)4;;;;;;/h;;;10*(H3,1,2,3,4);;;;;;/q3*+3;;;;;;;;;;;3*+2;;;/p-30 |
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| InChIKey | MMKWNBQTXIORSQ-UHFFFAOYSA-A |
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| XLogP | -29.40 |
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| TPSA | 862.50 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 40 |
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| Rotatable Bonds | |
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| Heavy Atoms | 59 |
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| Complexity | — |
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Lipinski Rule of Five
2 violations
| Rule | Value |
|---|
| MW ≤ 500 | 1891.67 |
| LogP ≤ 5 | -29.40 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 40 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate?
The IUPAC name of tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate (CID 173269238) is tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate.
What is the SMILES notation for tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate?
The canonical SMILES for tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate is O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Fe+3].[Fe+3].[Fe+3].[Pb+2].[Pb+2].[Pb+2].[V].[V].[V].
What is the InChIKey of tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate?
The InChIKey is MMKWNBQTXIORSQ-UHFFFAOYSA-A. The full InChI is InChI=1S/3Fe.10H3O4P.3Pb.3V/c;;;10*1-5(2,3)4;;;;;;/h;;;10*(H3,1,2,3,4);;;;;;/q3*+3;;;;;;;;;;;3*+2;;;/p-30.
What are the key properties of tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate?
tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate has a molecular weight of 1891.67 g/mol, XLogP of -29.40, 0 rotatable bonds, 0 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for tris(iron(3+));tris(lead(2+));tris(vanadium);decaphosphate is sourced from PubChem (CID 173269238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).