[6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane)

C104H107Ir3N7O2SSi6-6 — CID 158251644

About [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane)

[6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane) (PubChem CID 158251644) has the molecular formula C104H107Ir3N7O2SSi6-6 and a molecular weight of 2264.28 g/mol. Its IUPAC name is [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane).

Molecular Properties

• Compound Name: [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane)
• PubChem CID: 158251644
• Molecular Formula: C104H107Ir3N7O2SSi6-6
• Molecular Weight: 2264.28 g/mol
• Exact Mass: 2264.57
• IUPAC Name: [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane)
• SMILES: C[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1ccnc(-c2[c-]cccc2)c1.Cc1cc(-c2[c-]cc3c(c2)sc2ccccc23)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]ccc3c2oc2ccccc23)ncc1[Si](C)(C)C.Cc1ccc2c(n1)oc1c(-c3ccc([Si](C)(C)C)cn3)[c-]ccc12.[Ir].[Ir].[Ir]
• InChI: InChI=1S/C21H20NOSi.C21H20NSSi.C20H19N2OSi.3C14H16NSi.3Ir/c1-14-12-18(22-13-20(14)24(2,3)4)17-10-7-9-16-15-8-5-6-11-19(15)23-21(16)17;1-14-11-18(22-13-21(14)24(2,3)4)15-9-10-17-16-7-5-6-8-19(16)23-20(17)12-15;1-13-8-10-16-15-6-5-7-17(19(15)23-20(16)22-13)18-11-9-14(12-21-18)24(2,3)4;1-16(2,3)13-9-10-15-14(11-13)12-7-5-4-6-8-12;2*1-16(2,3)13-9-10-14(15-11-13)12-7-5-4-6-8-12;;;/h5-9,11-13H,1-4H3;5-8,10-13H,1-4H3;5-6,8-12H,1-4H3;3*4-7,9-11H,1-3H3;;;/q6*-1
• InChIKey: QQUQLMQYSCZGOO-UHFFFAOYSA-N
• XLogP: 25.04
• TPSA: 116.51 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 12
• Heavy Atoms: 123
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2264.28
LogP ≤ 5	25.04
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

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 [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane)?

The IUPAC name of [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane) (CID 158251644) is [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane).

What is the SMILES notation for [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane)?

The canonical SMILES for [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane) is C[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1ccnc(-c2[c-]cccc2)c1.Cc1cc(-c2[c-]cc3c(c2)sc2ccccc23)ncc1[Si](C)(C)C.Cc1cc(-c2[c-]ccc3c2oc2ccccc23)ncc1[Si](C)(C)C.Cc1ccc2c(n1)oc1c(-c3ccc([Si](C)(C)C)cn3)[c-]ccc12.[Ir].[Ir].[Ir].

What is the InChIKey of [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane)?

The InChIKey is QQUQLMQYSCZGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20NOSi.C21H20NSSi.C20H19N2OSi.3C14H16NSi.3Ir/c1-14-12-18(22-13-20(14)24(2,3)4)17-10-7-9-16-15-8-5-6-11-19(15)23-21(16)17;1-14-11-18(22-13-21(14)24(2,3)4)15-9-10-17-16-7-5-6-8-19(16)23-20(17)12-15;1-13-8-10-16-15-6-5-7-17(19(15)23-20(16)22-13)18-11-9-14(12-21-18)24(2,3)4;1-16(2,3)13-9-10-15-14(11-13)12-7-5-4-6-8-12;2*1-16(2,3)13-9-10-14(15-11-13)12-7-5-4-6-8-12;;;/h5-9,11-13H,1-4H3;5-8,10-13H,1-4H3;5-6,8-12H,1-4H3;3*4-7,9-11H,1-3H3;;;/q6*-1;;;.

What are the key properties of [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane)?

[6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane) has a molecular weight of 2264.28 g/mol, XLogP of 25.04, 12 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for [6-(3H-dibenzofuran-3-id-4-yl)-4-methyl-3-pyridinyl]-trimethylsilane;[6-(2H-dibenzothiophen-2-id-3-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tris(iridium);trimethyl-[6-(2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-id-8-yl)-3-pyridinyl]silane;trimethyl-(2-phenyl-4-pyridinyl)silane;bis(trimethyl-(6-phenyl-3-pyridinyl)silane) is sourced from PubChem (CID 158251644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).