lithium;iron;nitrite

FeLiNO2 — CID 174059577

IUPAClithium;iron;nitrite
SMILESO=N[O-].[Fe].[Li+]
InChIInChI=1S/Fe.Li.HNO2/c;;2-1-3/h;;(H,2,3)/q;+1;/p-1
InChIKeyLQNNSYVVLIVRGP-UHFFFAOYSA-M
MW108.79 g/mol
LogP-2.75
Rot. Bonds

About lithium;iron;nitrite

lithium;iron;nitrite (PubChem CID 174059577) has the molecular formula FeLiNO2 and a molecular weight of 108.79 g/mol. Its IUPAC name is lithium;iron;nitrite.

Molecular Properties

Compound Namelithium;iron;nitrite
PubChem CID174059577
Molecular FormulaFeLiNO2
Molecular Weight108.79 g/mol
Exact Mass108.94
IUPAC Namelithium;iron;nitrite
SMILESO=N[O-].[Fe].[Li+]
InChIInChI=1S/Fe.Li.HNO2/c;;2-1-3/h;;(H,2,3)/q;+1;/p-1
InChIKeyLQNNSYVVLIVRGP-UHFFFAOYSA-M
XLogP-2.75
TPSA52.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms5
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.79
LogP ≤ 5-2.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium;iron;nitrite?
The IUPAC name of lithium;iron;nitrite (CID 174059577) is lithium;iron;nitrite.
What is the SMILES notation for lithium;iron;nitrite?
The canonical SMILES for lithium;iron;nitrite is O=N[O-].[Fe].[Li+].
What is the InChIKey of lithium;iron;nitrite?
The InChIKey is LQNNSYVVLIVRGP-UHFFFAOYSA-M. The full InChI is InChI=1S/Fe.Li.HNO2/c;;2-1-3/h;;(H,2,3)/q;+1;/p-1.
What are the key properties of lithium;iron;nitrite?
lithium;iron;nitrite has a molecular weight of 108.79 g/mol, XLogP of -2.75, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;iron;nitrite is sourced from PubChem (CID 174059577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).