About dichloro-(2-phenylinden-1-ylidene)ruthenium
dichloro-(2-phenylinden-1-ylidene)ruthenium (PubChem CID 90375129) has the molecular formula C15H10Cl2Ru
and a molecular weight of 362.22 g/mol. Its IUPAC name is dichloro-(2-phenylinden-1-ylidene)ruthenium.
Molecular Properties
| Compound Name | dichloro-(2-phenylinden-1-ylidene)ruthenium |
| PubChem CID | 90375129 |
| Molecular Formula | C15H10Cl2Ru |
| Molecular Weight | 362.22 g/mol |
| Exact Mass | 361.92 |
| IUPAC Name | dichloro-(2-phenylinden-1-ylidene)ruthenium |
| SMILES | Cl[Ru](Cl)=C1C(c2ccccc2)=Cc2ccccc21 |
| InChI | InChI=1S/C15H10.2ClH.Ru/c1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;;;/h1-10H;2*1H;/q;;;+2/p-2 |
| InChIKey | BXYXBAZKBWIFPC-UHFFFAOYSA-L |
| XLogP | 4.69 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 362.22 |
| LogP ≤ 5 | 4.69 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'stilbene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of dichloro-(2-phenylinden-1-ylidene)ruthenium?
The IUPAC name of dichloro-(2-phenylinden-1-ylidene)ruthenium (CID 90375129) is dichloro-(2-phenylinden-1-ylidene)ruthenium.
What is the SMILES notation for dichloro-(2-phenylinden-1-ylidene)ruthenium?
The canonical SMILES for dichloro-(2-phenylinden-1-ylidene)ruthenium is Cl[Ru](Cl)=C1C(c2ccccc2)=Cc2ccccc21.
What is the InChIKey of dichloro-(2-phenylinden-1-ylidene)ruthenium?
The InChIKey is BXYXBAZKBWIFPC-UHFFFAOYSA-L. The full InChI is InChI=1S/C15H10.2ClH.Ru/c1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;;;/h1-10H;2*1H;/q;;;+2/p-2.
What are the key properties of dichloro-(2-phenylinden-1-ylidene)ruthenium?
dichloro-(2-phenylinden-1-ylidene)ruthenium has a molecular weight of 362.22 g/mol, XLogP of 4.69, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-(2-phenylinden-1-ylidene)ruthenium is sourced from PubChem (CID 90375129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).