platinum(2+);bis(pyridine-2-thiolate)

C10H8N2PtS2 — CID 12713197

IUPACplatinum(2+);bis(pyridine-2-thiolate)
SMILES[Pt+2].[S-]c1ccccn1.[S-]c1ccccn1
InChIInChI=1S/2C5H5NS.Pt/c2*7-5-3-1-2-4-6-5;/h2*1-4H,(H,6,7);/q;;+2/p-2
InChIKeyRQUFBNULAWBEHX-UHFFFAOYSA-L
MW415.40 g/mol
LogP1.97
Rot. Bonds

About platinum(2+);bis(pyridine-2-thiolate)

platinum(2+);bis(pyridine-2-thiolate) (PubChem CID 12713197) has the molecular formula C10H8N2PtS2 and a molecular weight of 415.40 g/mol. Its IUPAC name is platinum(2+);bis(pyridine-2-thiolate).

Molecular Properties

Compound Nameplatinum(2+);bis(pyridine-2-thiolate)
PubChem CID12713197
Molecular FormulaC10H8N2PtS2
Molecular Weight415.40 g/mol
Exact Mass414.98
IUPAC Nameplatinum(2+);bis(pyridine-2-thiolate)
SMILES[Pt+2].[S-]c1ccccn1.[S-]c1ccccn1
InChIInChI=1S/2C5H5NS.Pt/c2*7-5-3-1-2-4-6-5;/h2*1-4H,(H,6,7);/q;;+2/p-2
InChIKeyRQUFBNULAWBEHX-UHFFFAOYSA-L
XLogP1.97
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.40
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of platinum(2+);bis(pyridine-2-thiolate)?
The IUPAC name of platinum(2+);bis(pyridine-2-thiolate) (CID 12713197) is platinum(2+);bis(pyridine-2-thiolate).
What is the SMILES notation for platinum(2+);bis(pyridine-2-thiolate)?
The canonical SMILES for platinum(2+);bis(pyridine-2-thiolate) is [Pt+2].[S-]c1ccccn1.[S-]c1ccccn1.
What is the InChIKey of platinum(2+);bis(pyridine-2-thiolate)?
The InChIKey is RQUFBNULAWBEHX-UHFFFAOYSA-L. The full InChI is InChI=1S/2C5H5NS.Pt/c2*7-5-3-1-2-4-6-5;/h2*1-4H,(H,6,7);/q;;+2/p-2.
What are the key properties of platinum(2+);bis(pyridine-2-thiolate)?
platinum(2+);bis(pyridine-2-thiolate) has a molecular weight of 415.40 g/mol, XLogP of 1.97, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);bis(pyridine-2-thiolate) is sourced from PubChem (CID 12713197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).