About pentakis(dioxido(oxo)phosphanium);bis(niobium(5+))
pentakis(dioxido(oxo)phosphanium);bis(niobium(5+)) (PubChem CID 158087475) has the molecular formula Nb2O15P5+5
and a molecular weight of 580.67 g/mol. Its IUPAC name is pentakis(dioxido(oxo)phosphanium);bis(niobium(5+)).
Molecular Properties
| Compound Name | pentakis(dioxido(oxo)phosphanium);bis(niobium(5+)) |
|---|
| PubChem CID | 158087475 |
|---|
| Molecular Formula | Nb2O15P5+5 |
|---|
| Molecular Weight | 580.67 g/mol |
|---|
| Exact Mass | 580.60 |
|---|
| IUPAC Name | pentakis(dioxido(oxo)phosphanium);bis(niobium(5+)) |
|---|
| SMILES | O=[P+]([O-])[O-].O=[P+]([O-])[O-].O=[P+]([O-])[O-].O=[P+]([O-])[O-].O=[P+]([O-])[O-].[Nb+5].[Nb+5] |
|---|
| InChI | InChI=1S/2Nb.5HO3P/c;;5*1-4(2)3/h;;5*(H,1,2,3)/q2*+5;;;;;/p-5 |
|---|
| InChIKey | JPSRZUFPVOSCFL-UHFFFAOYSA-I |
|---|
| XLogP | -8.18 |
|---|
| TPSA | 315.95 Ų |
|---|
| H-Bond Donors | |
|---|
| H-Bond Acceptors | 15 |
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| Rotatable Bonds | |
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| Heavy Atoms | 22 |
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| Complexity | — |
|---|
Lipinski Rule of Five
2 violations
| Rule | Value |
|---|
| MW ≤ 500 | 580.67 |
| LogP ≤ 5 | -8.18 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of pentakis(dioxido(oxo)phosphanium);bis(niobium(5+))?
The IUPAC name of pentakis(dioxido(oxo)phosphanium);bis(niobium(5+)) (CID 158087475) is pentakis(dioxido(oxo)phosphanium);bis(niobium(5+)).
What is the SMILES notation for pentakis(dioxido(oxo)phosphanium);bis(niobium(5+))?
The canonical SMILES for pentakis(dioxido(oxo)phosphanium);bis(niobium(5+)) is O=[P+]([O-])[O-].O=[P+]([O-])[O-].O=[P+]([O-])[O-].O=[P+]([O-])[O-].O=[P+]([O-])[O-].[Nb+5].[Nb+5].
What is the InChIKey of pentakis(dioxido(oxo)phosphanium);bis(niobium(5+))?
The InChIKey is JPSRZUFPVOSCFL-UHFFFAOYSA-I. The full InChI is InChI=1S/2Nb.5HO3P/c;;5*1-4(2)3/h;;5*(H,1,2,3)/q2*+5;;;;;/p-5.
What are the key properties of pentakis(dioxido(oxo)phosphanium);bis(niobium(5+))?
pentakis(dioxido(oxo)phosphanium);bis(niobium(5+)) has a molecular weight of 580.67 g/mol, XLogP of -8.18, 0 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(dioxido(oxo)phosphanium);bis(niobium(5+)) is sourced from PubChem (CID 158087475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).