About hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate
hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate (PubChem CID 25113228) has the molecular formula H32N6O40W12
and a molecular weight of 2962.34 g/mol. Its IUPAC name is hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate.
Molecular Properties
| Compound Name | hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate |
| PubChem CID | 25113228 |
| Molecular Formula | H32N6O40W12 |
| Molecular Weight | 2962.34 g/mol |
| Exact Mass | 2963.48 |
| IUPAC Name | hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate |
| SMILES | O.O=[W](=O)([O-])O[W](=O)(=O)O[W](=O)(=O)O.O=[W](=O)([O-])O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)O.O=[W](=O)([O-])O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)O.[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[OH-].[OH-].[OH-].[W] |
| InChI | InChI=1S/6H3N.7H2O.33O.12W/h6*1H3;7*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;3*-1;;;;;;;;;;3*+1 |
| InChIKey | XHZLHTWMXVICQQ-UHFFFAOYSA-N |
| XLogP | -7.53 |
| TPSA | 919.75 Ų |
| H-Bond Donors | 9 |
| H-Bond Acceptors | 36 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 58 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
| MW ≤ 500 | 2962.34 |
| LogP ≤ 5 | -7.53 |
| H-Bond Donors ≤ 5 | 9 |
| H-Bond Acceptors ≤ 10 | 36 |
Analyze hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate with MolForge
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Frequently Asked Questions
What is the IUPAC name of hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate?
The IUPAC name of hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate (CID 25113228) is hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate.
What is the SMILES notation for hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate?
The canonical SMILES for hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate is O.O=[W](=O)([O-])O[W](=O)(=O)O[W](=O)(=O)O.O=[W](=O)([O-])O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)O.O=[W](=O)([O-])O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)O.[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[OH-].[OH-].[OH-].[W].
What is the InChIKey of hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate?
The InChIKey is XHZLHTWMXVICQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/6H3N.7H2O.33O.12W/h6*1H3;7*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;3*-1;;;;;;;;;;3*+1.
What are the key properties of hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate?
hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate has a molecular weight of 2962.34 g/mol, XLogP of -7.53, 16 rotatable bonds, 9 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for hexaazanium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate is sourced from PubChem (CID 25113228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).