About azane;platinum;trinitrate
azane;platinum;trinitrate (PubChem CID 173188765) has the molecular formula H12N7O9Pt-3
and a molecular weight of 449.21 g/mol. Its IUPAC name is azane;platinum;trinitrate.
Molecular Properties
| Compound Name | azane;platinum;trinitrate |
| PubChem CID | 173188765 |
| Molecular Formula | H12N7O9Pt-3 |
| Molecular Weight | 449.21 g/mol |
| Exact Mass | 449.04 |
| IUPAC Name | azane;platinum;trinitrate |
| SMILES | N.N.N.N.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Pt] |
| InChI | InChI=1S/3NO3.4H3N.Pt/c3*2-1(3)4;;;;;/h;;;4*1H3;/q3*-1;;;;; |
| InChIKey | SVSIZQLWZLPIFW-UHFFFAOYSA-N |
| XLogP | -0.07 |
| TPSA | 338.60 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 13 |
| Rotatable Bonds | |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 449.21 |
| LogP ≤ 5 | -0.07 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 13 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of azane;platinum;trinitrate?
The IUPAC name of azane;platinum;trinitrate (CID 173188765) is azane;platinum;trinitrate.
What is the SMILES notation for azane;platinum;trinitrate?
The canonical SMILES for azane;platinum;trinitrate is N.N.N.N.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Pt].
What is the InChIKey of azane;platinum;trinitrate?
The InChIKey is SVSIZQLWZLPIFW-UHFFFAOYSA-N. The full InChI is InChI=1S/3NO3.4H3N.Pt/c3*2-1(3)4;;;;;/h;;;4*1H3;/q3*-1;;;;;.
What are the key properties of azane;platinum;trinitrate?
azane;platinum;trinitrate has a molecular weight of 449.21 g/mol, XLogP of -0.07, 0 rotatable bonds, 4 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for azane;platinum;trinitrate is sourced from PubChem (CID 173188765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).