CID 139251089

C12H10PdSe2 — CID 139251089

IUPAC—
SMILES[Pd].[Se]c1ccccc1.[Se]c1ccccc1
InChIInChI=1S/2C6H5Se.Pd/c2*7-6-4-2-1-3-5-6;/h2*1-5H;
InChIKeyGIMBDKWDXCFXEB-UHFFFAOYSA-N
MW418.55 g/mol
LogP0.96
Rot. Bonds

About CID 139251089

CID 139251089 (PubChem CID 139251089) has the molecular formula C12H10PdSe2 and a molecular weight of 418.55 g/mol.

Molecular Properties

Compound NameCID 139251089
PubChem CID139251089
Molecular FormulaC12H10PdSe2
Molecular Weight418.55 g/mol
Exact Mass419.81
IUPAC Name—
SMILES[Pd].[Se]c1ccccc1.[Se]c1ccccc1
InChIInChI=1S/2C6H5Se.Pd/c2*7-6-4-2-1-3-5-6;/h2*1-5H;
InChIKeyGIMBDKWDXCFXEB-UHFFFAOYSA-N
XLogP0.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.55
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 139251089?
The IUPAC name of CID 139251089 (CID 139251089) is not available.
What is the SMILES notation for CID 139251089?
The canonical SMILES for CID 139251089 is [Pd].[Se]c1ccccc1.[Se]c1ccccc1.
What is the InChIKey of CID 139251089?
The InChIKey is GIMBDKWDXCFXEB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H5Se.Pd/c2*7-6-4-2-1-3-5-6;/h2*1-5H;.
What are the key properties of CID 139251089?
CID 139251089 has a molecular weight of 418.55 g/mol, XLogP of 0.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 139251089 is sourced from PubChem (CID 139251089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).