bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide

C32H22F4N4Pt2S2 — CID 140714185

About bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide

bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide (PubChem CID 140714185) has the molecular formula C32H22F4N4Pt2S2 and a molecular weight of 992.84 g/mol. Its IUPAC name is bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide.

Molecular Properties

• Compound Name: bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide
• PubChem CID: 140714185
• Molecular Formula: C32H22F4N4Pt2S2
• Molecular Weight: 992.84 g/mol
• Exact Mass: 992.05
• IUPAC Name: bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide
• SMILES: Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[Pt+2].[Pt+2].[S-]c1ccccn1.[SH-].c1ccncc1
• InChI: InChI=1S/2C11H6F2N.C5H5NS.C5H5N.2Pt.H2S/c2*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;7-5-3-1-2-4-6-5;1-2-4-6-5-3-1;;;/h2*1-4,6-7H;1-4H,(H,6,7);1-5H;;;1H2/q2*-1;;;2*+2;/p-2
• InChIKey: CCABPOMONCYVCV-UHFFFAOYSA-L
• XLogP: 7.45
• TPSA: 51.56 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 2
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	992.84
LogP ≤ 5	7.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide?

The IUPAC name of bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide (CID 140714185) is bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide.

What is the SMILES notation for bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide?

The canonical SMILES for bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide is Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[Pt+2].[Pt+2].[S-]c1ccccn1.[SH-].c1ccncc1.

What is the InChIKey of bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide?

The InChIKey is CCABPOMONCYVCV-UHFFFAOYSA-L. The full InChI is InChI=1S/2C11H6F2N.C5H5NS.C5H5N.2Pt.H2S/c2*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;7-5-3-1-2-4-6-5;1-2-4-6-5-3-1;;;/h2*1-4,6-7H;1-4H,(H,6,7);1-5H;;;1H2/q2*-1;;;2*+2;/p-2.

What are the key properties of bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide?

bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide has a molecular weight of 992.84 g/mol, XLogP of 7.45, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);bis(platinum(2+));pyridine;pyridine-2-thiolate;sulfanide is sourced from PubChem (CID 140714185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).