azanium;cerium;dinitrate

H4CeN3O6- — CID 158195246

IUPACazanium;cerium;dinitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ce].[NH4+]
InChIInChI=1S/Ce.2NO3.H3N/c;2*2-1(3)4;/h;;;1H3/q;2*-1;/p+1
InChIKeyOACDBKNZUVHMHH-UHFFFAOYSA-O
MW282.16 g/mol
LogP-0.10
Rot. Bonds

About azanium;cerium;dinitrate

azanium;cerium;dinitrate (PubChem CID 158195246) has the molecular formula H4CeN3O6- and a molecular weight of 282.16 g/mol. Its IUPAC name is azanium;cerium;dinitrate.

Molecular Properties

Compound Nameazanium;cerium;dinitrate
PubChem CID158195246
Molecular FormulaH4CeN3O6-
Molecular Weight282.16 g/mol
Exact Mass281.92
IUPAC Nameazanium;cerium;dinitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ce].[NH4+]
InChIInChI=1S/Ce.2NO3.H3N/c;2*2-1(3)4;/h;;;1H3/q;2*-1;/p+1
InChIKeyOACDBKNZUVHMHH-UHFFFAOYSA-O
XLogP-0.10
TPSA168.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.16
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of azanium;cerium;dinitrate?
The IUPAC name of azanium;cerium;dinitrate (CID 158195246) is azanium;cerium;dinitrate.
What is the SMILES notation for azanium;cerium;dinitrate?
The canonical SMILES for azanium;cerium;dinitrate is O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ce].[NH4+].
What is the InChIKey of azanium;cerium;dinitrate?
The InChIKey is OACDBKNZUVHMHH-UHFFFAOYSA-O. The full InChI is InChI=1S/Ce.2NO3.H3N/c;2*2-1(3)4;/h;;;1H3/q;2*-1;/p+1.
What are the key properties of azanium;cerium;dinitrate?
azanium;cerium;dinitrate has a molecular weight of 282.16 g/mol, XLogP of -0.10, 0 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;cerium;dinitrate is sourced from PubChem (CID 158195246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).