About copper;oxocopper;dinitrate
copper;oxocopper;dinitrate (PubChem CID 158560469) has the molecular formula Cu2N2O7
and a molecular weight of 267.10 g/mol. Its IUPAC name is copper;oxocopper;dinitrate.
Molecular Properties
| Compound Name | copper;oxocopper;dinitrate |
| PubChem CID | 158560469 |
| Molecular Formula | Cu2N2O7 |
| Molecular Weight | 267.10 g/mol |
| Exact Mass | 265.83 |
| IUPAC Name | copper;oxocopper;dinitrate |
| SMILES | O=[Cu].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Cu+2] |
| InChI | InChI=1S/2Cu.2NO3.O/c;;2*2-1(3)4;/q;+2;2*-1; |
| InChIKey | HQUYBLKIOPTDRU-UHFFFAOYSA-N |
| XLogP | -0.60 |
| TPSA | 149.47 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 267.10 |
| LogP ≤ 5 | -0.60 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 7 |
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 copper;oxocopper;dinitrate?
The IUPAC name of copper;oxocopper;dinitrate (CID 158560469) is copper;oxocopper;dinitrate.
What is the SMILES notation for copper;oxocopper;dinitrate?
The canonical SMILES for copper;oxocopper;dinitrate is O=[Cu].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Cu+2].
What is the InChIKey of copper;oxocopper;dinitrate?
The InChIKey is HQUYBLKIOPTDRU-UHFFFAOYSA-N. The full InChI is InChI=1S/2Cu.2NO3.O/c;;2*2-1(3)4;/q;+2;2*-1;.
What are the key properties of copper;oxocopper;dinitrate?
copper;oxocopper;dinitrate has a molecular weight of 267.10 g/mol, XLogP of -0.60, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for copper;oxocopper;dinitrate is sourced from PubChem (CID 158560469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).