8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane

C207H174Ir3N16PtSSi2- — CID 157090678

About 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane

8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane (PubChem CID 157090678) has the molecular formula C207H174Ir3N16PtSSi2- and a molecular weight of 3745.75 g/mol. Its IUPAC name is 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane.

Molecular Properties

• Compound Name: 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane
• PubChem CID: 157090678
• Molecular Formula: C207H174Ir3N16PtSSi2-
• Molecular Weight: 3745.75 g/mol
• Exact Mass: 3745.19
• IUPAC Name: 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane
• SMILES: CC(C)c1cccc(C(C)C)c1-n1ccnc1-c1[c-]cccc1.C[Si](C)(C)c1ccc2c(c1)-c1ccc([Si](C)(C)C)c[n+]1C2.Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1ccccc1C1=C(c2ccccc2C)N(c2ccccc2)[CH-]N1c1[c-]cccc1.[Ir+3].[Ir].[Ir].[Pt+2].[c-]1ccccc1-c1cc2c(cn1)[nH]c1cc3c(cc12)c1ccccc1n3-c1ccccc1.[c-]1ccccc1-c1ccc2c(n1)N1c3nc(-c4[c-]cccc4)ccc3Cc3cccc(c31)C2.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1cc2c3c(c1)sc1ccc[n+](c13)C2.c1cc[n+]2c(c1)-c1c3ccc(c1C2)CCc1ccc(cc1)CC3.c1ccccc1
• InChI: InChI=1S/C30H19N3.C29H18N3.C29H24N2.C22H20N.C21H23N2.C18H26NSi2.C18H14N.C12H8NS.2C11H8N.C6H6.3Ir.Pt/c1-3-8-20(9-4-1)26-16-14-24-18-22-12-7-13-23-19-25-15-17-27(21-10-5-2-6-11-21)32-30(25)33(28(22)23)29(24)31-26;1-3-9-19(10-4-1)25-16-23-22-15-24-21-13-7-8-14-28(21)32(20-11-5-2-6-12-20)29(24)17-26(22)31-27(23)18-30-25;1-22-13-9-11-19-26(22)28-29(27-20-12-10-14-23(27)2)31(25-17-7-4-8-18-25)21-30(28)24-15-5-3-6-16-24;1-2-14-23-15-20-18-10-8-16-4-6-17(7-5-16)9-11-19(13-12-18)22(20)21(23)3-1;1-15(2)18-11-8-12-19(16(3)4)20(18)23-14-13-22-21(23)17-9-6-5-7-10-17;1-20(2,3)15-8-7-14-12-19-13-16(21(4,5)6)9-10-18(19)17(14)11-15;1-14-12-18(16-10-6-3-7-11-16)19-13-17(14)15-8-4-2-5-9-15;1-3-8-7-13-6-2-5-10-12(13)11(8)9(4-1)14-10;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-2-4-6-5-3-1;;;;/h1-8,10,12-17H,18-19H2;1-9,11-18,31H;3-17,19-21H,1-2H3;1-7,12-14H,8-11,15H2;5-9,11-16H,1-4H3;7-11,13H,12H2,1-6H3;2-10,12-13H,1H3;1-6H,7H2;2*1-6,8-9H;1-6H;;;;/q-2;-1;-2;+1;-1;+1;-1;+1;2*-1;;;;+3;+2
• InChIKey: TXZOLZCMFXQNGH-UHFFFAOYSA-N
• XLogP: 47.61
• TPSA: 137.24 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 13
• Rotatable Bonds: 18
• Heavy Atoms: 230
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3745.75
LogP ≤ 5	47.61
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane?

The IUPAC name of 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane (CID 157090678) is 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane.

What is the SMILES notation for 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane?

The canonical SMILES for 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane is CC(C)c1cccc(C(C)C)c1-n1ccnc1-c1[c-]cccc1.C[Si](C)(C)c1ccc2c(c1)-c1ccc([Si](C)(C)C)c[n+]1C2.Cc1cc(-c2[c-]cccc2)ncc1-c1ccccc1.Cc1ccccc1C1=C(c2ccccc2C)N(c2ccccc2)[CH-]N1c1[c-]cccc1.[Ir+3].[Ir].[Ir].[Pt+2].[c-]1ccccc1-c1cc2c(cn1)[nH]c1cc3c(cc12)c1ccccc1n3-c1ccccc1.[c-]1ccccc1-c1ccc2c(n1)N1c3nc(-c4[c-]cccc4)ccc3Cc3cccc(c31)C2.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1cc2c3c(c1)sc1ccc[n+](c13)C2.c1cc[n+]2c(c1)-c1c3ccc(c1C2)CCc1ccc(cc1)CC3.c1ccccc1.

What is the InChIKey of 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane?

The InChIKey is TXZOLZCMFXQNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19N3.C29H18N3.C29H24N2.C22H20N.C21H23N2.C18H26NSi2.C18H14N.C12H8NS.2C11H8N.C6H6.3Ir.Pt/c1-3-8-20(9-4-1)26-16-14-24-18-22-12-7-13-23-19-25-15-17-27(21-10-5-2-6-11-21)32-30(25)33(28(22)23)29(24)31-26;1-3-9-19(10-4-1)25-16-23-22-15-24-21-13-7-8-14-28(21)32(20-11-5-2-6-12-20)29(24)17-26(22)31-27(23)18-30-25;1-22-13-9-11-19-26(22)28-29(27-20-12-10-14-23(27)2)31(25-17-7-4-8-18-25)21-30(28)24-15-5-3-6-16-24;1-2-14-23-15-20-18-10-8-16-4-6-17(7-5-16)9-11-19(13-12-18)22(20)21(23)3-1;1-15(2)18-11-8-12-19(16(3)4)20(18)23-14-13-22-21(23)17-9-6-5-7-10-17;1-20(2,3)15-8-7-14-12-19-13-16(21(4,5)6)9-10-18(19)17(14)11-15;1-14-12-18(16-10-6-3-7-11-16)19-13-17(14)15-8-4-2-5-9-15;1-3-8-7-13-6-2-5-10-12(13)11(8)9(4-1)14-10;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-2-4-6-5-3-1;;;;/h1-8,10,12-17H,18-19H2;1-9,11-18,31H;3-17,19-21H,1-2H3;1-7,12-14H,8-11,15H2;5-9,11-16H,1-4H3;7-11,13H,12H2,1-6H3;2-10,12-13H,1H3;1-6H,7H2;2*1-6,8-9H;1-6H;;;;/q-2;-1;-2;+1;-1;+1;-1;+1;2*-1;;;;+3;+2.

What are the key properties of 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane?

8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane has a molecular weight of 3745.75 g/mol, XLogP of 47.61, 18 rotatable bonds, 1 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 8-azoniapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3,5,7,10,14,16,20,22-nonaene;benzene;4,5-bis(2-methylphenyl)-1-phenyl-3-phenyl-2H-imidazol-2-ide;4,18-di(phenyl)-1,3,19-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(iridium);iridium(3+);4-methyl-5-phenyl-2-phenylpyridine;14-phenyl-6-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;bis(2-phenylpyridine);platinum(2+);6-thia-1-azoniatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7,9,11-hexaene;trimethyl-(3-trimethylsilyl-6H-pyrido[2,1-a]isoindol-5-ium-9-yl)silane is sourced from PubChem (CID 157090678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).