lithium;benzene;lanthanum(3+)

C24H20LaLi — CID 134899326

IUPAClithium;benzene;lanthanum(3+)
SMILES[La+3].[Li+].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/4C6H5.La.Li/c4*1-2-4-6-5-3-1;;/h4*1-5H;;/q4*-1;+3;+1
InChIKeyFJZXFIGZTAYTKH-UHFFFAOYSA-N
MW454.27 g/mol
LogP2.95
Rot. Bonds

About lithium;benzene;lanthanum(3+)

lithium;benzene;lanthanum(3+) (PubChem CID 134899326) has the molecular formula C24H20LaLi and a molecular weight of 454.27 g/mol. Its IUPAC name is lithium;benzene;lanthanum(3+).

Molecular Properties

Compound Namelithium;benzene;lanthanum(3+)
PubChem CID134899326
Molecular FormulaC24H20LaLi
Molecular Weight454.27 g/mol
Exact Mass454.08
IUPAC Namelithium;benzene;lanthanum(3+)
SMILES[La+3].[Li+].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/4C6H5.La.Li/c4*1-2-4-6-5-3-1;;/h4*1-5H;;/q4*-1;+3;+1
InChIKeyFJZXFIGZTAYTKH-UHFFFAOYSA-N
XLogP2.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.27
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium;benzene;lanthanum(3+)?
The IUPAC name of lithium;benzene;lanthanum(3+) (CID 134899326) is lithium;benzene;lanthanum(3+).
What is the SMILES notation for lithium;benzene;lanthanum(3+)?
The canonical SMILES for lithium;benzene;lanthanum(3+) is [La+3].[Li+].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.
What is the InChIKey of lithium;benzene;lanthanum(3+)?
The InChIKey is FJZXFIGZTAYTKH-UHFFFAOYSA-N. The full InChI is InChI=1S/4C6H5.La.Li/c4*1-2-4-6-5-3-1;;/h4*1-5H;;/q4*-1;+3;+1.
What are the key properties of lithium;benzene;lanthanum(3+)?
lithium;benzene;lanthanum(3+) has a molecular weight of 454.27 g/mol, XLogP of 2.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;benzene;lanthanum(3+) is sourced from PubChem (CID 134899326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).