lithium;iron;cyanide

CFeLiN — CID 174264357

IUPAClithium;iron;cyanide
SMILES[C-]#N.[Fe].[Li+]
InChIInChI=1S/CN.Fe.Li/c1-2;;/q-1;;+1
InChIKeyUGNAFBZWLQXVPE-UHFFFAOYSA-N
MW88.80 g/mol
LogP-2.90
Rot. Bonds

About lithium;iron;cyanide

lithium;iron;cyanide (PubChem CID 174264357) has the molecular formula CFeLiN and a molecular weight of 88.80 g/mol. Its IUPAC name is lithium;iron;cyanide.

Molecular Properties

Compound Namelithium;iron;cyanide
PubChem CID174264357
Molecular FormulaCFeLiN
Molecular Weight88.80 g/mol
Exact Mass88.95
IUPAC Namelithium;iron;cyanide
SMILES[C-]#N.[Fe].[Li+]
InChIInChI=1S/CN.Fe.Li/c1-2;;/q-1;;+1
InChIKeyUGNAFBZWLQXVPE-UHFFFAOYSA-N
XLogP-2.90
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.80
LogP ≤ 5-2.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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CID 88812666
CID 88812666
disodium;hydride;iron;cyanide
CID 174748463
dipotassium;cobalt(2+);iron;hexacyanide
CID 170853485
CID 134877915
CID 134877915
iron;manganese;nickel;cyanide
CID 175608785
potassium;hydride;iron;zinc;cyanide
CID 173426971
potassium;hydride;iron;iron(6+);hexacyanide
CID 173004482
titanium cyanide
CID 159591841
sodium cyanide
CID 8929

Frequently Asked Questions

What is the IUPAC name of lithium;iron;cyanide?
The IUPAC name of lithium;iron;cyanide (CID 174264357) is lithium;iron;cyanide.
What is the SMILES notation for lithium;iron;cyanide?
The canonical SMILES for lithium;iron;cyanide is [C-]#N.[Fe].[Li+].
What is the InChIKey of lithium;iron;cyanide?
The InChIKey is UGNAFBZWLQXVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/CN.Fe.Li/c1-2;;/q-1;;+1.
What are the key properties of lithium;iron;cyanide?
lithium;iron;cyanide has a molecular weight of 88.80 g/mol, XLogP of -2.90, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;iron;cyanide is sourced from PubChem (CID 174264357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).