azanium;cerium(3+);disulfite

H4CeNO6S2 — CID 159572517

IUPACazanium;cerium(3+);disulfite
SMILESO=S([O-])[O-].O=S([O-])[O-].[Ce+3].[NH4+]
InChIInChI=1S/Ce.H3N.2H2O3S/c;;2*1-4(2)3/h;1H3;2*(H2,1,2,3)/q+3;;;/p-3
InChIKeyMHZPJHOOASFYIU-UHFFFAOYSA-K
MW318.28 g/mol
LogP-1.63
Rot. Bonds

About azanium;cerium(3+);disulfite

azanium;cerium(3+);disulfite (PubChem CID 159572517) has the molecular formula H4CeNO6S2 and a molecular weight of 318.28 g/mol. Its IUPAC name is azanium;cerium(3+);disulfite.

Molecular Properties

Compound Nameazanium;cerium(3+);disulfite
PubChem CID159572517
Molecular FormulaH4CeNO6S2
Molecular Weight318.28 g/mol
Exact Mass317.85
IUPAC Nameazanium;cerium(3+);disulfite
SMILESO=S([O-])[O-].O=S([O-])[O-].[Ce+3].[NH4+]
InChIInChI=1S/Ce.H3N.2H2O3S/c;;2*1-4(2)3/h;1H3;2*(H2,1,2,3)/q+3;;;/p-3
InChIKeyMHZPJHOOASFYIU-UHFFFAOYSA-K
XLogP-1.63
TPSA162.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.28
LogP ≤ 5-1.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

cobalt(2+) sulfite
CID 18760923
ruthenium(2+) sulfite
CID 22610794
dicopper disulfite
CID 170844287
disodium;sulfite
CID 516934
bis(lutetium(3+));trisulfite
CID 159878392
chromium(2+) sulfite
CID 22462027
calcium;magnesium;disulfite
CID 22465809
disodium;sulfite;hexahydrate
CID 158498638
sodium;sulfite;hydrate
CID 19366461
hydron;iron(2+);sulfite
CID 20545645
calcium;sulfite;dihydrate
CID 23448497
disodium;methane;sulfite
CID 86619477

Frequently Asked Questions

What is the IUPAC name of azanium;cerium(3+);disulfite?
The IUPAC name of azanium;cerium(3+);disulfite (CID 159572517) is azanium;cerium(3+);disulfite.
What is the SMILES notation for azanium;cerium(3+);disulfite?
The canonical SMILES for azanium;cerium(3+);disulfite is O=S([O-])[O-].O=S([O-])[O-].[Ce+3].[NH4+].
What is the InChIKey of azanium;cerium(3+);disulfite?
The InChIKey is MHZPJHOOASFYIU-UHFFFAOYSA-K. The full InChI is InChI=1S/Ce.H3N.2H2O3S/c;;2*1-4(2)3/h;1H3;2*(H2,1,2,3)/q+3;;;/p-3.
What are the key properties of azanium;cerium(3+);disulfite?
azanium;cerium(3+);disulfite has a molecular weight of 318.28 g/mol, XLogP of -1.63, 0 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;cerium(3+);disulfite is sourced from PubChem (CID 159572517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).