About CID 10976438
CID 10976438 (PubChem CID 10976438) has the molecular formula C10H8FeLi2+2
and a molecular weight of 197.90 g/mol.
Molecular Properties
| Compound Name | CID 10976438 |
|---|
| PubChem CID | 10976438 |
|---|
| Molecular Formula | C10H8FeLi2+2 |
|---|
| Molecular Weight | 197.90 g/mol |
|---|
| Exact Mass | 198.03 |
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| IUPAC Name | — |
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| SMILES | [C-]1[CH][CH][CH][CH]1.[C-]1[CH][CH][CH][CH]1.[Fe+2].[Li+].[Li+] |
|---|
| InChI | InChI=1S/2C5H4.Fe.2Li/c2*1-2-4-5-3-1;;;/h2*1-4H;;;/q2*-1;+2;2*+1 |
|---|
| InChIKey | YXWVMDALHZSJHG-UHFFFAOYSA-N |
|---|
| XLogP | -4.20 |
|---|
| TPSA | 0.00 Ų |
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| H-Bond Donors | |
|---|
| H-Bond Acceptors | |
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| Rotatable Bonds | |
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| Heavy Atoms | 13 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 197.90 |
| LogP ≤ 5 | -4.20 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of CID 10976438?
The IUPAC name of CID 10976438 (CID 10976438) is not available.
What is the SMILES notation for CID 10976438?
The canonical SMILES for CID 10976438 is [C-]1[CH][CH][CH][CH]1.[C-]1[CH][CH][CH][CH]1.[Fe+2].[Li+].[Li+].
What is the InChIKey of CID 10976438?
The InChIKey is YXWVMDALHZSJHG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H4.Fe.2Li/c2*1-2-4-5-3-1;;;/h2*1-4H;;;/q2*-1;+2;2*+1.
What are the key properties of CID 10976438?
CID 10976438 has a molecular weight of 197.90 g/mol, XLogP of -4.20, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10976438 is sourced from PubChem (CID 10976438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).