5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium)

C100H78F3Ir4N11O2-8 — CID 161491335

About 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium)

5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium) (PubChem CID 161491335) has the molecular formula C100H78F3Ir4N11O2-8 and a molecular weight of 2291.66 g/mol. Its IUPAC name is 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium).

Molecular Properties

• Compound Name: 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium)
• PubChem CID: 161491335
• Molecular Formula: C100H78F3Ir4N11O2-8
• Molecular Weight: 2291.66 g/mol
• Exact Mass: 2293.49
• IUPAC Name: 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium)
• SMILES: Cc1cc(C)cc(N2[CH-]N(c3[c-]cccc3)c3cc(-c4cccc5c4oc4ccccc45)ccc32)c1.Cc1cc(C)cc(N2[CH-]N(c3[c-]cccc3)c3ccc(OC(F)(F)F)cc32)c1.Cc1cc(C)cc(N2[CH-]N(c3[c-]cccc3)c3ccccc32)c1.Cc1cc(N2[CH-]N(c3[c-]cccc3)c3nccnc32)cc(C)c1-c1ccncc1.[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/C33H24N2O.C24H19N5.C22H17F3N2O.C21H18N2.4Ir/c1-22-17-23(2)19-26(18-22)35-21-34(25-9-4-3-5-10-25)31-20-24(15-16-30(31)35)27-12-8-13-29-28-11-6-7-14-32(28)36-33(27)29;1-17-14-21(15-18(2)22(17)19-8-10-25-11-9-19)29-16-28(20-6-4-3-5-7-20)23-24(29)27-13-12-26-23;1-15-10-16(2)12-18(11-15)27-14-26(17-6-4-3-5-7-17)20-9-8-19(13-21(20)27)28-22(23,24)25;1-16-12-17(2)14-19(13-16)23-15-22(18-8-4-3-5-9-18)20-10-6-7-11-21(20)23;;;;/h3-9,11-21H,1-2H3;3-6,8-16H,1-2H3;3-6,8-14H,1-2H3;3-8,10-15H,1-2H3;;;;/q4*-2
• InChIKey: YVMOLFBFGOXQHK-UHFFFAOYSA-N
• XLogP: 26.36
• TPSA: 86.96 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 11
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2291.66
LogP ≤ 5	26.36
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium)?

The IUPAC name of 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium) (CID 161491335) is 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium).

What is the SMILES notation for 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium)?

The canonical SMILES for 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium) is Cc1cc(C)cc(N2[CH-]N(c3[c-]cccc3)c3cc(-c4cccc5c4oc4ccccc45)ccc32)c1.Cc1cc(C)cc(N2[CH-]N(c3[c-]cccc3)c3ccc(OC(F)(F)F)cc32)c1.Cc1cc(C)cc(N2[CH-]N(c3[c-]cccc3)c3ccccc32)c1.Cc1cc(N2[CH-]N(c3[c-]cccc3)c3nccnc32)cc(C)c1-c1ccncc1.[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium)?

The InChIKey is YVMOLFBFGOXQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H24N2O.C24H19N5.C22H17F3N2O.C21H18N2.4Ir/c1-22-17-23(2)19-26(18-22)35-21-34(25-9-4-3-5-10-25)31-20-24(15-16-30(31)35)27-12-8-13-29-28-11-6-7-14-32(28)36-33(27)29;1-17-14-21(15-18(2)22(17)19-8-10-25-11-9-19)29-16-28(20-6-4-3-5-7-20)23-24(29)27-13-12-26-23;1-15-10-16(2)12-18(11-15)27-14-26(17-6-4-3-5-7-17)20-9-8-19(13-21(20)27)28-22(23,24)25;1-16-12-17(2)14-19(13-16)23-15-22(18-8-4-3-5-9-18)20-10-6-7-11-21(20)23;;;;/h3-9,11-21H,1-2H3;3-6,8-16H,1-2H3;3-6,8-14H,1-2H3;3-8,10-15H,1-2H3;;;;/q4*-2;;;;.

What are the key properties of 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium)?

5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium) has a molecular weight of 2291.66 g/mol, XLogP of 26.36, 11 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 5-dibenzofuran-4-yl-1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;1-(3,5-dimethylphenyl)-3-phenyl-2H-benzimidazol-2-ide;3-(3,5-dimethylphenyl)-1-phenyl-5-(trifluoromethoxy)-2H-benzimidazol-2-ide;3-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-ide;tetrakis(iridium) is sourced from PubChem (CID 161491335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).