platinum(4+);sulfonato sulfate

O14PtS4 — CID 57353350

IUPACplatinum(4+);sulfonato sulfate
SMILESO=S(=O)([O-])OS(=O)(=O)[O-].O=S(=O)([O-])OS(=O)(=O)[O-].[Pt+4]
InChIInChI=1S/2H2O7S2.Pt/c2*1-8(2,3)7-9(4,5)6;/h2*(H,1,2,3)(H,4,5,6);/q;;+4/p-4
InChIKeySRBAUCXPNREGLR-UHFFFAOYSA-J
MW547.33 g/mol
LogP-4.16
Rot. Bonds4

About platinum(4+);sulfonato sulfate

platinum(4+);sulfonato sulfate (PubChem CID 57353350) has the molecular formula O14PtS4 and a molecular weight of 547.33 g/mol. Its IUPAC name is platinum(4+);sulfonato sulfate.

Molecular Properties

Compound Nameplatinum(4+);sulfonato sulfate
PubChem CID57353350
Molecular FormulaO14PtS4
Molecular Weight547.33 g/mol
Exact Mass546.78
IUPAC Nameplatinum(4+);sulfonato sulfate
SMILESO=S(=O)([O-])OS(=O)(=O)[O-].O=S(=O)([O-])OS(=O)(=O)[O-].[Pt+4]
InChIInChI=1S/2H2O7S2.Pt/c2*1-8(2,3)7-9(4,5)6;/h2*(H,1,2,3)(H,4,5,6);/q;;+4/p-4
InChIKeySRBAUCXPNREGLR-UHFFFAOYSA-J
XLogP-4.16
TPSA247.26 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500547.33
LogP ≤ 5-4.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

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Related Compounds

aluminum;sodium;sulfonato sulfate
CID 159964180
copper;hydrazine;sulfonato sulfate
CID 158083856
sulfonato sulfate;bis(tetramethylphosphanium)
CID 174869555
dipotassium;sulfonatooxysulfonothioyl sulfate
CID 174554201
potassium sulfo sulfate
CID 157130711
potassium;sulfo sulfate;sulfuric acid
CID 158562224
sodium sulfooxysulfonyl sulfate
CID 175371917
azanide;platinum(4+);sulfate
CID 131883140
dicalcium sulfonatooxy sulfate
CID 159780487
strontium sulfonatooxy sulfate
CID 21114005
dipotassium;sulfonatooxy sulfate
CID 516926
bis(rubidium(1+));sulfonatooxy sulfate
CID 18406061

Frequently Asked Questions

What is the IUPAC name of platinum(4+);sulfonato sulfate?
The IUPAC name of platinum(4+);sulfonato sulfate (CID 57353350) is platinum(4+);sulfonato sulfate.
What is the SMILES notation for platinum(4+);sulfonato sulfate?
The canonical SMILES for platinum(4+);sulfonato sulfate is O=S(=O)([O-])OS(=O)(=O)[O-].O=S(=O)([O-])OS(=O)(=O)[O-].[Pt+4].
What is the InChIKey of platinum(4+);sulfonato sulfate?
The InChIKey is SRBAUCXPNREGLR-UHFFFAOYSA-J. The full InChI is InChI=1S/2H2O7S2.Pt/c2*1-8(2,3)7-9(4,5)6;/h2*(H,1,2,3)(H,4,5,6);/q;;+4/p-4.
What are the key properties of platinum(4+);sulfonato sulfate?
platinum(4+);sulfonato sulfate has a molecular weight of 547.33 g/mol, XLogP of -4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(4+);sulfonato sulfate is sourced from PubChem (CID 57353350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).