[6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane

C160H138Ir4N10OSSi4-8 — CID 160737438

IUPAC[6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane
SMILESCCn1c2c[c-]c(-c3cc(-c4ccc(C)cc4)c([Si](C)(C)C)cn3)cc2c2ccccc21.Cc1ccc(-c2cc(-c3[c-]cc4c(c3)c3ccccc3n4-c3ccccc3)ncc2[Si](C)(C)C)cc1.Cc1ccc(-c2cc(-c3[c-]cc4oc5ccccc5c4c3)ncc2[Si](C)(C)C)cc1.Cc1ccc(-c2cc(-c3[c-]cc4sc5ccccc5c4c3)ncc2[Si](C)(C)C)cc1.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C33H29N2Si.C29H29N2Si.C27H24NOSi.C27H24NSSi.4C11H8N.4Ir/c1-23-14-16-24(17-15-23)28-21-30(34-22-33(28)36(2,3)4)25-18-19-32-29(20-25)27-12-8-9-13-31(27)35(32)26-10-6-5-7-11-26;1-6-31-27-10-8-7-9-23(27)25-17-22(15-16-28(25)31)26-18-24(21-13-11-20(2)12-14-21)29(19-30-26)32(3,4)5;2*1-18-9-11-19(12-10-18)22-16-24(28-17-27(22)30(2,3)4)20-13-14-26-23(15-20)21-7-5-6-8-25(21)29-26;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;/h5-17,19-22H,1-4H3;7-14,16-19H,6H2,1-5H3;2*5-12,14-17H,1-4H3;4*1-6,8-9H;;;;/q8*-1;;;;
InChIKeyJNHGFGDYXUWAFH-UHFFFAOYSA-N
MW3130.21 g/mol
LogP39.96
Rot. Bonds18

About [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane

[6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane (PubChem CID 160737438) has the molecular formula C160H138Ir4N10OSSi4-8 and a molecular weight of 3130.21 g/mol. Its IUPAC name is [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane.

Molecular Properties

Compound Name[6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane
PubChem CID160737438
Molecular FormulaC160H138Ir4N10OSSi4-8
Molecular Weight3130.21 g/mol
Exact Mass3130.84
IUPAC Name[6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane
SMILESCCn1c2c[c-]c(-c3cc(-c4ccc(C)cc4)c([Si](C)(C)C)cn3)cc2c2ccccc21.Cc1ccc(-c2cc(-c3[c-]cc4c(c3)c3ccccc3n4-c3ccccc3)ncc2[Si](C)(C)C)cc1.Cc1ccc(-c2cc(-c3[c-]cc4oc5ccccc5c4c3)ncc2[Si](C)(C)C)cc1.Cc1ccc(-c2cc(-c3[c-]cc4sc5ccccc5c4c3)ncc2[Si](C)(C)C)cc1.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C33H29N2Si.C29H29N2Si.C27H24NOSi.C27H24NSSi.4C11H8N.4Ir/c1-23-14-16-24(17-15-23)28-21-30(34-22-33(28)36(2,3)4)25-18-19-32-29(20-25)27-12-8-9-13-31(27)35(32)26-10-6-5-7-11-26;1-6-31-27-10-8-7-9-23(27)25-17-22(15-16-28(25)31)26-18-24(21-13-11-20(2)12-14-21)29(19-30-26)32(3,4)5;2*1-18-9-11-19(12-10-18)22-16-24(28-17-27(22)30(2,3)4)20-13-14-26-23(15-20)21-7-5-6-8-25(21)29-26;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;/h5-17,19-22H,1-4H3;7-14,16-19H,6H2,1-5H3;2*5-12,14-17H,1-4H3;4*1-6,8-9H;;;;/q8*-1;;;;
InChIKeyJNHGFGDYXUWAFH-UHFFFAOYSA-N
XLogP39.96
TPSA126.12 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds18
Heavy Atoms180
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003130.21
LogP ≤ 539.96
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 [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane?
The IUPAC name of [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane (CID 160737438) is [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane.
What is the SMILES notation for [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane?
The canonical SMILES for [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane is CCn1c2c[c-]c(-c3cc(-c4ccc(C)cc4)c([Si](C)(C)C)cn3)cc2c2ccccc21.Cc1ccc(-c2cc(-c3[c-]cc4c(c3)c3ccccc3n4-c3ccccc3)ncc2[Si](C)(C)C)cc1.Cc1ccc(-c2cc(-c3[c-]cc4oc5ccccc5c4c3)ncc2[Si](C)(C)C)cc1.Cc1ccc(-c2cc(-c3[c-]cc4sc5ccccc5c4c3)ncc2[Si](C)(C)C)cc1.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.
What is the InChIKey of [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane?
The InChIKey is JNHGFGDYXUWAFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H29N2Si.C29H29N2Si.C27H24NOSi.C27H24NSSi.4C11H8N.4Ir/c1-23-14-16-24(17-15-23)28-21-30(34-22-33(28)36(2,3)4)25-18-19-32-29(20-25)27-12-8-9-13-31(27)35(32)26-10-6-5-7-11-26;1-6-31-27-10-8-7-9-23(27)25-17-22(15-16-28(25)31)26-18-24(21-13-11-20(2)12-14-21)29(19-30-26)32(3,4)5;2*1-18-9-11-19(12-10-18)22-16-24(28-17-27(22)30(2,3)4)20-13-14-26-23(15-20)21-7-5-6-8-25(21)29-26;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;/h5-17,19-22H,1-4H3;7-14,16-19H,6H2,1-5H3;2*5-12,14-17H,1-4H3;4*1-6,8-9H;;;;/q8*-1;;;;.
What are the key properties of [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane?
[6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane has a molecular weight of 3130.21 g/mol, XLogP of 39.96, 18 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3H-dibenzofuran-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-(4-methylphenyl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine);trimethyl-[4-(4-methylphenyl)-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane is sourced from PubChem (CID 160737438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).