[4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane)

C171H143Ir4N9O4S3Si4-8 — CID 159698771

About [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane)

[4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane) (PubChem CID 159698771) has the molecular formula C171H143Ir4N9O4S3Si4-8 and a molecular weight of 3365.50 g/mol. Its IUPAC name is [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane).

Molecular Properties

• Compound Name: [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane)
• PubChem CID: 159698771
• Molecular Formula: C171H143Ir4N9O4S3Si4-8
• Molecular Weight: 3365.50 g/mol
• Exact Mass: 3365.81
• IUPAC Name: [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane)
• SMILES: CC(C)(C)c1cc(-c2[c-]ccc(Oc3ccccc3)c2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]ccc(Oc3ccccc3)c2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]ccc(Oc3ccccc3)c2)cc1-c1ccccc1.Cc1cc(-c2[c-]ccc(Oc3ccccc3)c2)ncc1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir].[c-]1cc2c(cc1-c1ccccn1)sc1ccccc12.[c-]1cc2c(cc1-c1ccccn1)sc1ccccc12.[c-]1cc2c(cc1-c1ccccn1)sc1ccccc12.[c-]1cc2c3ccccc3n(-c3ccccc3)c2cc1-c1ccccn1
• InChI: InChI=1S/2C26H24NOSi.C24H28NOSi.C23H15N2.C21H22NOSi.3C17H10NS.4Ir/c2*1-29(2,3)26-19-27-25(18-24(26)20-11-6-4-7-12-20)21-13-10-16-23(17-21)28-22-14-8-5-9-15-22;1-24(2,3)21-16-22(25-17-23(21)27(4,5)6)18-11-10-14-20(15-18)26-19-12-8-7-9-13-19;1-2-8-18(9-3-1)25-22-12-5-4-10-19(22)20-14-13-17(16-23(20)25)21-11-6-7-15-24-21;1-16-13-20(22-15-21(16)24(2,3)4)17-9-8-12-19(14-17)23-18-10-6-5-7-11-18;3*1-2-7-16-13(5-1)14-9-8-12(11-17(14)19-16)15-6-3-4-10-18-15;;;;/h2*4-12,14-19H,1-3H3;7-10,12-17H,1-6H3;1-12,14-16H;5-8,10-15H,1-4H3;3*1-7,9-11H;;;;/q8*-1
• InChIKey: ZLJNRYKVJKYQKY-UHFFFAOYSA-N
• XLogP: 44.87
• TPSA: 144.97 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 23
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3365.50
LogP ≤ 5	44.87
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane)?

The IUPAC name of [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane) (CID 159698771) is [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane).

What is the SMILES notation for [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane)?

The canonical SMILES for [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane) is CC(C)(C)c1cc(-c2[c-]ccc(Oc3ccccc3)c2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]ccc(Oc3ccccc3)c2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]ccc(Oc3ccccc3)c2)cc1-c1ccccc1.Cc1cc(-c2[c-]ccc(Oc3ccccc3)c2)ncc1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir].[c-]1cc2c(cc1-c1ccccn1)sc1ccccc12.[c-]1cc2c(cc1-c1ccccn1)sc1ccccc12.[c-]1cc2c(cc1-c1ccccn1)sc1ccccc12.[c-]1cc2c3ccccc3n(-c3ccccc3)c2cc1-c1ccccn1.

What is the InChIKey of [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane)?

The InChIKey is ZLJNRYKVJKYQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H24NOSi.C24H28NOSi.C23H15N2.C21H22NOSi.3C17H10NS.4Ir/c2*1-29(2,3)26-19-27-25(18-24(26)20-11-6-4-7-12-20)21-13-10-16-23(17-21)28-22-14-8-5-9-15-22;1-24(2,3)21-16-22(25-17-23(21)27(4,5)6)18-11-10-14-20(15-18)26-19-12-8-7-9-13-19;1-2-8-18(9-3-1)25-22-12-5-4-10-19(22)20-14-13-17(16-23(20)25)21-11-6-7-15-24-21;1-16-13-20(22-15-21(16)24(2,3)4)17-9-8-12-19(14-17)23-18-10-6-5-7-11-18;3*1-2-7-16-13(5-1)14-9-8-12(11-17(14)19-16)15-6-3-4-10-18-15;;;;/h2*4-12,14-19H,1-3H3;7-10,12-17H,1-6H3;1-12,14-16H;5-8,10-15H,1-4H3;3*1-7,9-11H;;;;/q8*-1;;;;.

What are the key properties of [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane)?

[4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane) has a molecular weight of 3365.50 g/mol, XLogP of 44.87, 23 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for [4-tert-butyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tris(2-(2H-dibenzothiophen-2-id-3-yl)pyridine);tetrakis(iridium);9-phenyl-2-pyridin-2-yl-3H-carbazol-3-ide;trimethyl-[4-methyl-6-(3-phenoxybenzene-6-id-1-yl)-3-pyridinyl]silane;bis(trimethyl-[6-(3-phenoxybenzene-6-id-1-yl)-4-phenyl-3-pyridinyl]silane) is sourced from PubChem (CID 159698771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).