iron;iron(3+);sulfanide

H2Fe2S2+ — CID 5460691

About iron;iron(3+);sulfanide

iron;iron(3+);sulfanide (PubChem CID 5460691) has the molecular formula H2Fe2S2+ and a molecular weight of 177.84 g/mol. Its IUPAC name is iron;iron(3+);sulfanide.

Molecular Properties

• Compound Name: iron;iron(3+);sulfanide
• PubChem CID: 5460691
• Molecular Formula: H2Fe2S2+
• Molecular Weight: 177.84 g/mol
• Exact Mass: 177.83
• IUPAC Name: iron;iron(3+);sulfanide
• SMILES: [Fe+3].[Fe].[SH-].[SH-]
• InChI: InChI=1S/2Fe.2H2S/h;;2*1H2/q;+3;;/p-2
• InChIKey: ASRGRFCBJWADTH-UHFFFAOYSA-L
• XLogP: -0.55
• TPSA: 0.00 Ų
• H-Bond Acceptors: 2
• Heavy Atoms: 4
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	177.84
LogP ≤ 5	-0.55
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', '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 iron;iron(3+);sulfanide?

The IUPAC name of iron;iron(3+);sulfanide (CID 5460691) is iron;iron(3+);sulfanide.

What is the SMILES notation for iron;iron(3+);sulfanide?

The canonical SMILES for iron;iron(3+);sulfanide is [Fe+3].[Fe].[SH-].[SH-].

What is the InChIKey of iron;iron(3+);sulfanide?

The InChIKey is ASRGRFCBJWADTH-UHFFFAOYSA-L. The full InChI is InChI=1S/2Fe.2H2S/h;;2*1H2/q;+3;;/p-2.

What are the key properties of iron;iron(3+);sulfanide?

iron;iron(3+);sulfanide has a molecular weight of 177.84 g/mol, XLogP of -0.55, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for iron;iron(3+);sulfanide is sourced from PubChem (CID 5460691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).