About calcium;barium(2+);hydride;silane;zinc
calcium;barium(2+);hydride;silane;zinc (PubChem CID 174922647) has the molecular formula H8BaCaSiZn
and a molecular weight of 278.95 g/mol. Its IUPAC name is calcium;barium(2+);hydride;silane;zinc.
Molecular Properties
| Compound Name | calcium;barium(2+);hydride;silane;zinc |
|---|
| PubChem CID | 174922647 |
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| Molecular Formula | H8BaCaSiZn |
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| Molecular Weight | 278.95 g/mol |
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| Exact Mass | 277.84 |
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| IUPAC Name | calcium;barium(2+);hydride;silane;zinc |
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| SMILES | [Ba+2].[Ca+2].[H-].[H-].[H-].[H-].[SiH4].[Zn] |
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| InChI | InChI=1S/Ba.Ca.H4Si.Zn.4H/h;;1H4;;;;;/q2*+2;;;4*-1 |
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| InChIKey | XHTBZVSBYJOEPS-UHFFFAOYSA-N |
|---|
| XLogP | -1.77 |
|---|
| TPSA | 0.00 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | |
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| Rotatable Bonds | |
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| Heavy Atoms | 4 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 278.95 |
| LogP ≤ 5 | -1.77 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 calcium;barium(2+);hydride;silane;zinc?
The IUPAC name of calcium;barium(2+);hydride;silane;zinc (CID 174922647) is calcium;barium(2+);hydride;silane;zinc.
What is the SMILES notation for calcium;barium(2+);hydride;silane;zinc?
The canonical SMILES for calcium;barium(2+);hydride;silane;zinc is [Ba+2].[Ca+2].[H-].[H-].[H-].[H-].[SiH4].[Zn].
What is the InChIKey of calcium;barium(2+);hydride;silane;zinc?
The InChIKey is XHTBZVSBYJOEPS-UHFFFAOYSA-N. The full InChI is InChI=1S/Ba.Ca.H4Si.Zn.4H/h;;1H4;;;;;/q2*+2;;;4*-1.
What are the key properties of calcium;barium(2+);hydride;silane;zinc?
calcium;barium(2+);hydride;silane;zinc has a molecular weight of 278.95 g/mol, XLogP of -1.77, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;barium(2+);hydride;silane;zinc is sourced from PubChem (CID 174922647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).