dilithium;hydride;1,2,2-triphenylethenylbenzene

C26H22Li2 — CID 173364079

IUPACdilithium;hydride;1,2,2-triphenylethenylbenzene
SMILES[H-].[H-].[Li+].[Li+].c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H20.2Li.2H/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24;;;;/h1-20H;;;;/q;2*+1;2*-1
InChIKeyIFIKLYYDLVZQHL-UHFFFAOYSA-N
MW348.34 g/mol
LogP0.93
Rot. Bonds4

About dilithium;hydride;1,2,2-triphenylethenylbenzene

dilithium;hydride;1,2,2-triphenylethenylbenzene (PubChem CID 173364079) has the molecular formula C26H22Li2 and a molecular weight of 348.34 g/mol. Its IUPAC name is dilithium;hydride;1,2,2-triphenylethenylbenzene.

Molecular Properties

Compound Namedilithium;hydride;1,2,2-triphenylethenylbenzene
PubChem CID173364079
Molecular FormulaC26H22Li2
Molecular Weight348.34 g/mol
Exact Mass348.20
IUPAC Namedilithium;hydride;1,2,2-triphenylethenylbenzene
SMILES[H-].[H-].[Li+].[Li+].c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H20.2Li.2H/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24;;;;/h1-20H;;;;/q;2*+1;2*-1
InChIKeyIFIKLYYDLVZQHL-UHFFFAOYSA-N
XLogP0.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.34
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dilithium;hydride;1,2,2-triphenylethenylbenzene?
The IUPAC name of dilithium;hydride;1,2,2-triphenylethenylbenzene (CID 173364079) is dilithium;hydride;1,2,2-triphenylethenylbenzene.
What is the SMILES notation for dilithium;hydride;1,2,2-triphenylethenylbenzene?
The canonical SMILES for dilithium;hydride;1,2,2-triphenylethenylbenzene is [H-].[H-].[Li+].[Li+].c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of dilithium;hydride;1,2,2-triphenylethenylbenzene?
The InChIKey is IFIKLYYDLVZQHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20.2Li.2H/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24;;;;/h1-20H;;;;/q;2*+1;2*-1.
What are the key properties of dilithium;hydride;1,2,2-triphenylethenylbenzene?
dilithium;hydride;1,2,2-triphenylethenylbenzene has a molecular weight of 348.34 g/mol, XLogP of 0.93, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;hydride;1,2,2-triphenylethenylbenzene is sourced from PubChem (CID 173364079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).