nickel(2+);tin(2+);disulfate

NiO8S2Sn — CID 175997919

About nickel(2+);tin(2+);disulfate

nickel(2+);tin(2+);disulfate (PubChem CID 175997919) has the molecular formula NiO8S2Sn and a molecular weight of 369.53 g/mol. Its IUPAC name is nickel(2+);tin(2+);disulfate.

Molecular Properties

• Compound Name: nickel(2+);tin(2+);disulfate
• PubChem CID: 175997919
• Molecular Formula: NiO8S2Sn
• Molecular Weight: 369.53 g/mol
• Exact Mass: 369.74
• IUPAC Name: nickel(2+);tin(2+);disulfate
• SMILES: O=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[Ni+2].[Sn+2]
• InChI: InChI=1S/Ni.2H2O4S.Sn/c;2*1-5(2,3)4;/h;2*(H2,1,2,3,4);/q+2;;;+2/p-4
• InChIKey: ODJPQSILXLLGJE-UHFFFAOYSA-J
• XLogP: -3.06
• TPSA: 160.52 Ų
• H-Bond Acceptors: 8
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	369.53
LogP ≤ 5	-3.06
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of nickel(2+);tin(2+);disulfate?

The IUPAC name of nickel(2+);tin(2+);disulfate (CID 175997919) is nickel(2+);tin(2+);disulfate.

What is the SMILES notation for nickel(2+);tin(2+);disulfate?

The canonical SMILES for nickel(2+);tin(2+);disulfate is O=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[Ni+2].[Sn+2].

What is the InChIKey of nickel(2+);tin(2+);disulfate?

The InChIKey is ODJPQSILXLLGJE-UHFFFAOYSA-J. The full InChI is InChI=1S/Ni.2H2O4S.Sn/c;2*1-5(2,3)4;/h;2*(H2,1,2,3,4);/q+2;;;+2/p-4.

What are the key properties of nickel(2+);tin(2+);disulfate?

nickel(2+);tin(2+);disulfate has a molecular weight of 369.53 g/mol, XLogP of -3.06, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for nickel(2+);tin(2+);disulfate is sourced from PubChem (CID 175997919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).