chloro(diiodo)iridium;phosphane

H6ClI2IrP2 — CID 134956742

IUPACchloro(diiodo)iridium;phosphane
SMILESCl[Ir](I)I.P.P
InChIInChI=1S/ClH.2HI.Ir.2H3P/h3*1H;;2*1H3/q;;;+3;;/p-3
InChIKeyXISGCJGWSHWEMT-UHFFFAOYSA-K
MW549.47 g/mol
LogP2.57
Rot. Bonds

About chloro(diiodo)iridium;phosphane

chloro(diiodo)iridium;phosphane (PubChem CID 134956742) has the molecular formula H6ClI2IrP2 and a molecular weight of 549.47 g/mol. Its IUPAC name is chloro(diiodo)iridium;phosphane.

Molecular Properties

Compound Namechloro(diiodo)iridium;phosphane
PubChem CID134956742
Molecular FormulaH6ClI2IrP2
Molecular Weight549.47 g/mol
Exact Mass549.74
IUPAC Namechloro(diiodo)iridium;phosphane
SMILESCl[Ir](I)I.P.P
InChIInChI=1S/ClH.2HI.Ir.2H3P/h3*1H;;2*1H3/q;;;+3;;/p-3
InChIKeyXISGCJGWSHWEMT-UHFFFAOYSA-K
XLogP2.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500549.47
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro(diiodo)iridium;phosphane?
The IUPAC name of chloro(diiodo)iridium;phosphane (CID 134956742) is chloro(diiodo)iridium;phosphane.
What is the SMILES notation for chloro(diiodo)iridium;phosphane?
The canonical SMILES for chloro(diiodo)iridium;phosphane is Cl[Ir](I)I.P.P.
What is the InChIKey of chloro(diiodo)iridium;phosphane?
The InChIKey is XISGCJGWSHWEMT-UHFFFAOYSA-K. The full InChI is InChI=1S/ClH.2HI.Ir.2H3P/h3*1H;;2*1H3/q;;;+3;;/p-3.
What are the key properties of chloro(diiodo)iridium;phosphane?
chloro(diiodo)iridium;phosphane has a molecular weight of 549.47 g/mol, XLogP of 2.57, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(diiodo)iridium;phosphane is sourced from PubChem (CID 134956742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).