About pentaiodotantalum
pentaiodotantalum (PubChem CID 4204915) has the molecular formula I5Ta
and a molecular weight of 815.47 g/mol. Its IUPAC name is pentaiodotantalum.
Molecular Properties
| Compound Name | pentaiodotantalum |
|---|
| PubChem CID | 4204915 |
|---|
| Molecular Formula | I5Ta |
|---|
| Molecular Weight | 815.47 g/mol |
|---|
| Exact Mass | 815.47 |
|---|
| IUPAC Name | pentaiodotantalum |
|---|
| SMILES | I[Ta](I)(I)(I)I |
|---|
| InChI | InChI=1S/5HI.Ta/h5*1H;/q;;;;;+5/p-5 |
|---|
| InChIKey | MISXNQITXACHNJ-UHFFFAOYSA-I |
|---|
| XLogP | 4.43 |
|---|
| TPSA | 0.00 Ų |
|---|
| H-Bond Donors | |
|---|
| H-Bond Acceptors | |
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| Rotatable Bonds | |
|---|
| Heavy Atoms | 6 |
|---|
| Complexity | — |
|---|
Lipinski Rule of Five
1 violation
| Rule | Value |
|---|
| MW ≤ 500 | 815.47 |
| LogP ≤ 5 | 4.43 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'iodine', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of pentaiodotantalum?
The IUPAC name of pentaiodotantalum (CID 4204915) is pentaiodotantalum.
What is the SMILES notation for pentaiodotantalum?
The canonical SMILES for pentaiodotantalum is I[Ta](I)(I)(I)I.
What is the InChIKey of pentaiodotantalum?
The InChIKey is MISXNQITXACHNJ-UHFFFAOYSA-I. The full InChI is InChI=1S/5HI.Ta/h5*1H;/q;;;;;+5/p-5.
What are the key properties of pentaiodotantalum?
pentaiodotantalum has a molecular weight of 815.47 g/mol, XLogP of 4.43, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pentaiodotantalum is sourced from PubChem (CID 4204915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).