About trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide
trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide (PubChem CID 173155086) has the molecular formula H7Fe3Mg3Mn3O28Si7
and a molecular weight of 1056.89 g/mol. Its IUPAC name is trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide.
Molecular Properties
| Compound Name | trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide |
|---|
| PubChem CID | 173155086 |
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| Molecular Formula | H7Fe3Mg3Mn3O28Si7 |
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| Molecular Weight | 1056.89 g/mol |
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| Exact Mass | 1055.32 |
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| IUPAC Name | trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide |
|---|
| SMILES | O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Fe+3].[Fe+3].[Fe+3].[Mg+2].[Mg+2].[Mg+2].[Mn+2].[Mn+2].[Mn+2].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-] |
|---|
| InChI | InChI=1S/3Fe.3Mg.3Mn.7O3Si.7H2O/c;;;;;;;;;7*1-4(2)3;;;;;;;/h;;;;;;;;;;;;;;;;7*1H2/q3*+3;6*+2;7*-2;;;;;;;/p-7 |
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| InChIKey | NKGFTDOEAQKETG-UHFFFAOYSA-G |
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| XLogP | -22.54 |
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| TPSA | 652.33 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 28 |
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| Rotatable Bonds | |
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| Heavy Atoms | 44 |
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| Complexity | — |
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Lipinski Rule of Five
2 violations
| Rule | Value |
|---|
| MW ≤ 500 | 1056.89 |
| LogP ≤ 5 | -22.54 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 28 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide?
The IUPAC name of trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide (CID 173155086) is trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide.
What is the SMILES notation for trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide?
The canonical SMILES for trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide is O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Fe+3].[Fe+3].[Fe+3].[Mg+2].[Mg+2].[Mg+2].[Mn+2].[Mn+2].[Mn+2].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].
What is the InChIKey of trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide?
The InChIKey is NKGFTDOEAQKETG-UHFFFAOYSA-G. The full InChI is InChI=1S/3Fe.3Mg.3Mn.7O3Si.7H2O/c;;;;;;;;;7*1-4(2)3;;;;;;;/h;;;;;;;;;;;;;;;;7*1H2/q3*+3;6*+2;7*-2;;;;;;;/p-7.
What are the key properties of trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide?
trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide has a molecular weight of 1056.89 g/mol, XLogP of -22.54, 0 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for trimagnesium;heptakis(dioxido(oxo)silane);tris(iron(3+));tris(manganese(2+));heptahydroxide is sourced from PubChem (CID 173155086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).