[4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane

C143H136Ir4N8O4Si4-8 — CID 158698473

IUPAC[4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane
SMILESC[Si](C)(C)c1c[c-]c(-c2ccc(C3CCCCC3)cn2)c2oc3ccccc3c12.C[Si](C)(C)c1ccc2oc3c(-c4ccc(C5CCCCC5)cn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2oc3c(-c4ccc(C5CCCCC5)cn4)[c-]ccc3c12.Cc1ccnc(-c2[c-]ccc3c2oc2c([Si](C)(C)C)cccc23)c1.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/3C26H28NOSi.C21H20NOSi.4C11H8N.4Ir/c1-29(2,3)24-14-8-13-23-25(24)21-12-7-11-20(26(21)28-23)22-16-15-19(17-27-22)18-9-5-4-6-10-18;1-29(2,3)24-16-14-20(26-25(24)21-11-7-8-12-23(21)28-26)22-15-13-19(17-27-22)18-9-5-4-6-10-18;1-29(2,3)20-13-15-25-23(16-20)21-10-7-11-22(26(21)28-25)24-14-12-19(17-27-24)18-8-5-4-6-9-18;1-14-11-12-22-18(13-14)17-9-5-7-15-16-8-6-10-19(24(2,3)4)21(16)23-20(15)17;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;/h7-8,12-18H,4-6,9-10H2,1-3H3;7-8,11-13,15-18H,4-6,9-10H2,1-3H3;7,10,12-18H,4-6,8-9H2,1-3H3;5-8,10-13H,1-4H3;4*1-6,8-9H;;;;/q8*-1;;;;
InChIKeyGZHKSSGVLDMNBQ-UHFFFAOYSA-N
MW2911.92 g/mol
LogP36.61
Rot. Bonds15

About [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane

[4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane (PubChem CID 158698473) has the molecular formula C143H136Ir4N8O4Si4-8 and a molecular weight of 2911.92 g/mol. Its IUPAC name is [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane.

Molecular Properties

Compound Name[4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane
PubChem CID158698473
Molecular FormulaC143H136Ir4N8O4Si4-8
Molecular Weight2911.92 g/mol
Exact Mass2912.83
IUPAC Name[4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane
SMILESC[Si](C)(C)c1c[c-]c(-c2ccc(C3CCCCC3)cn2)c2oc3ccccc3c12.C[Si](C)(C)c1ccc2oc3c(-c4ccc(C5CCCCC5)cn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2oc3c(-c4ccc(C5CCCCC5)cn4)[c-]ccc3c12.Cc1ccnc(-c2[c-]ccc3c2oc2c([Si](C)(C)C)cccc23)c1.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/3C26H28NOSi.C21H20NOSi.4C11H8N.4Ir/c1-29(2,3)24-14-8-13-23-25(24)21-12-7-11-20(26(21)28-23)22-16-15-19(17-27-22)18-9-5-4-6-10-18;1-29(2,3)24-16-14-20(26-25(24)21-11-7-8-12-23(21)28-26)22-15-13-19(17-27-22)18-9-5-4-6-10-18;1-29(2,3)20-13-15-25-23(16-20)21-10-7-11-22(26(21)28-25)24-14-12-19(17-27-24)18-8-5-4-6-9-18;1-14-11-12-22-18(13-14)17-9-5-7-15-16-8-6-10-19(24(2,3)4)21(16)23-20(15)17;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;/h7-8,12-18H,4-6,9-10H2,1-3H3;7-8,11-13,15-18H,4-6,9-10H2,1-3H3;7,10,12-18H,4-6,8-9H2,1-3H3;5-8,10-13H,1-4H3;4*1-6,8-9H;;;;/q8*-1;;;;
InChIKeyGZHKSSGVLDMNBQ-UHFFFAOYSA-N
XLogP36.61
TPSA155.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds15
Heavy Atoms163
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002911.92
LogP ≤ 536.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane?
The IUPAC name of [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane (CID 158698473) is [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane.
What is the SMILES notation for [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane?
The canonical SMILES for [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane is C[Si](C)(C)c1c[c-]c(-c2ccc(C3CCCCC3)cn2)c2oc3ccccc3c12.C[Si](C)(C)c1ccc2oc3c(-c4ccc(C5CCCCC5)cn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2oc3c(-c4ccc(C5CCCCC5)cn4)[c-]ccc3c12.Cc1ccnc(-c2[c-]ccc3c2oc2c([Si](C)(C)C)cccc23)c1.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.
What is the InChIKey of [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane?
The InChIKey is GZHKSSGVLDMNBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C26H28NOSi.C21H20NOSi.4C11H8N.4Ir/c1-29(2,3)24-14-8-13-23-25(24)21-12-7-11-20(26(21)28-23)22-16-15-19(17-27-22)18-9-5-4-6-10-18;1-29(2,3)24-16-14-20(26-25(24)21-11-7-8-12-23(21)28-26)22-15-13-19(17-27-22)18-9-5-4-6-10-18;1-29(2,3)20-13-15-25-23(16-20)21-10-7-11-22(26(21)28-25)24-14-12-19(17-27-24)18-8-5-4-6-9-18;1-14-11-12-22-18(13-14)17-9-5-7-15-16-8-6-10-19(24(2,3)4)21(16)23-20(15)17;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;/h7-8,12-18H,4-6,9-10H2,1-3H3;7-8,11-13,15-18H,4-6,9-10H2,1-3H3;7,10,12-18H,4-6,8-9H2,1-3H3;5-8,10-13H,1-4H3;4*1-6,8-9H;;;;/q8*-1;;;;.
What are the key properties of [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane?
[4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane has a molecular weight of 2911.92 g/mol, XLogP of 36.61, 15 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-1-yl]-trimethylsilane;[6-(5-cyclohexyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[6-(4-methyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]silane is sourced from PubChem (CID 158698473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).