magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate

C107H125AgBrCl5F4Ir3MgN10O5- — CID 158958808

About magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate

magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate (PubChem CID 158958808) has the molecular formula C107H125AgBrCl5F4Ir3MgN10O5- and a molecular weight of 2673.23 g/mol. Its IUPAC name is magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate.

Molecular Properties

• Compound Name: magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate
• PubChem CID: 158958808
• Molecular Formula: C107H125AgBrCl5F4Ir3MgN10O5-
• Molecular Weight: 2673.23 g/mol
• Exact Mass: 2669.52
• IUPAC Name: magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate
• SMILES: CCCCCCc1ccc(-n2ccnc2-c2[c-]cccc2)cc1.CCCCCCc1ccc(-n2ccnc2-c2[c-]cccc2)cc1.CCCCCCc1ccc(-n2ccnc2-c2ccccc2)cc1.CCCCCCc1ccc(-n2ccnc2-c2ccccc2)cc1.Cl[Ir+]Cl.Cl[Ir](Cl)Cl.Fc1ccc(-n2ccnc2-c2ccccc2)cc1.O.O.O.O=C(O)C(F)(F)F.[Ag].[Br-].[CH2-]CCCCC.[Ir].[Mg+2]
• InChI: InChI=1S/2C21H24N2.2C21H23N2.C15H11FN2.C6H13.C2HF3O2.Ag.BrH.5ClH.3Ir.Mg.3H2O/c4*1-2-3-4-6-9-18-12-14-20(15-13-18)23-17-16-22-21(23)19-10-7-5-8-11-19;16-13-6-8-14(9-7-13)18-11-10-17-15(18)12-4-2-1-3-5-12;1-3-5-6-4-2;3-2(4,5)1(6)7;;;;;;;;;;;;;;/h2*5,7-8,10-17H,2-4,6,9H2,1H3;2*5,7-8,10,12-17H,2-4,6,9H2,1H3;1-11H;1,3-6H2,2H3;(H,6,7);;6*1H;;;;;3*1H2/q;;2*-1;;-1;;;;;;;;;;2*+3;+2;;;/p-6
• InChIKey: DTVMDCILUMXONI-UHFFFAOYSA-H
• XLogP: 26.55
• TPSA: 220.90 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 11
• Rotatable Bonds: 33
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2673.23
LogP ≤ 5	26.55
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate?

The IUPAC name of magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate (CID 158958808) is magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate.

What is the SMILES notation for magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate?

The canonical SMILES for magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate is CCCCCCc1ccc(-n2ccnc2-c2[c-]cccc2)cc1.CCCCCCc1ccc(-n2ccnc2-c2[c-]cccc2)cc1.CCCCCCc1ccc(-n2ccnc2-c2ccccc2)cc1.CCCCCCc1ccc(-n2ccnc2-c2ccccc2)cc1.Cl[Ir+]Cl.Cl[Ir](Cl)Cl.Fc1ccc(-n2ccnc2-c2ccccc2)cc1.O.O.O.O=C(O)C(F)(F)F.[Ag].[Br-].[CH2-]CCCCC.[Ir].[Mg+2].

What is the InChIKey of magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate?

The InChIKey is DTVMDCILUMXONI-UHFFFAOYSA-H. The full InChI is InChI=1S/2C21H24N2.2C21H23N2.C15H11FN2.C6H13.C2HF3O2.Ag.BrH.5ClH.3Ir.Mg.3H2O/c4*1-2-3-4-6-9-18-12-14-20(15-13-18)23-17-16-22-21(23)19-10-7-5-8-11-19;16-13-6-8-14(9-7-13)18-11-10-17-15(18)12-4-2-1-3-5-12;1-3-5-6-4-2;3-2(4,5)1(6)7;;;;;;;;;;;;;;/h2*5,7-8,10-17H,2-4,6,9H2,1H3;2*5,7-8,10,12-17H,2-4,6,9H2,1H3;1-11H;1,3-6H2,2H3;(H,6,7);;6*1H;;;;;3*1H2/q;;2*-1;;-1;;;;;;;;;;2*+3;+2;;;/p-6.

What are the key properties of magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate?

magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate has a molecular weight of 2673.23 g/mol, XLogP of 26.55, 33 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for magnesium;dichloroiridium(1+);1-(4-fluorophenyl)-2-phenylimidazole;hexane;bis(1-(4-hexylphenyl)-2-phenylimidazole);bis(1-(4-hexylphenyl)-2-phenylimidazole);iridium;silver;trichloroiridium;2,2,2-trifluoroacetic acid;bromide;trihydrate is sourced from PubChem (CID 158958808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).