CID 22834374

C12H8Cl4N4PtSe2+2 — CID 22834374

IUPAC—
SMILESCl[Pt](Cl)(Cl)Cl.c1ccc2c(c1)=N[Se+]N=2.c1ccc2c(c1)=N[Se+]N=2
InChIInChI=1S/2C6H4N2Se.4ClH.Pt/c2*1-2-4-6-5(3-1)7-9-8-6;;;;;/h2*1-4H;4*1H;/q2*+1;;;;;+4/p-4
InChIKeyGUDKZVGSJIFSBU-UHFFFAOYSA-J
MW703.03 g/mol
LogP1.70
Rot. Bonds

About CID 22834374

CID 22834374 (PubChem CID 22834374) has the molecular formula C12H8Cl4N4PtSe2+2 and a molecular weight of 703.03 g/mol.

Molecular Properties

Compound NameCID 22834374
PubChem CID22834374
Molecular FormulaC12H8Cl4N4PtSe2+2
Molecular Weight703.03 g/mol
Exact Mass702.75
IUPAC Name—
SMILESCl[Pt](Cl)(Cl)Cl.c1ccc2c(c1)=N[Se+]N=2.c1ccc2c(c1)=N[Se+]N=2
InChIInChI=1S/2C6H4N2Se.4ClH.Pt/c2*1-2-4-6-5(3-1)7-9-8-6;;;;;/h2*1-4H;4*1H;/q2*+1;;;;;+4/p-4
InChIKeyGUDKZVGSJIFSBU-UHFFFAOYSA-J
XLogP1.70
TPSA49.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500703.03
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 22834374?
The IUPAC name of CID 22834374 (CID 22834374) is not available.
What is the SMILES notation for CID 22834374?
The canonical SMILES for CID 22834374 is Cl[Pt](Cl)(Cl)Cl.c1ccc2c(c1)=N[Se+]N=2.c1ccc2c(c1)=N[Se+]N=2.
What is the InChIKey of CID 22834374?
The InChIKey is GUDKZVGSJIFSBU-UHFFFAOYSA-J. The full InChI is InChI=1S/2C6H4N2Se.4ClH.Pt/c2*1-2-4-6-5(3-1)7-9-8-6;;;;;/h2*1-4H;4*1H;/q2*+1;;;;;+4/p-4.
What are the key properties of CID 22834374?
CID 22834374 has a molecular weight of 703.03 g/mol, XLogP of 1.70, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22834374 is sourced from PubChem (CID 22834374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).