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

C119H100Ir3N8SSi3-6 — CID 157054415

IUPAC[6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane
SMILESCCn1c2c[c-]c(-c3cc(-c4ccccc4)c([Si](C)(C)C)cn3)cc2c2ccccc21.C[Si](C)(C)c1cnc(-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cc3sc4ccccc4c3c2)cc1-c1ccccc1.[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C32H27N2Si.C28H27N2Si.C26H22NSSi.3C11H8N.3Ir/c1-35(2,3)32-22-33-29(21-27(32)23-12-6-4-7-13-23)24-18-19-31-28(20-24)26-16-10-11-17-30(26)34(31)25-14-8-5-9-15-25;1-5-30-26-14-10-9-13-22(26)24-17-21(15-16-27(24)30)25-18-23(20-11-7-6-8-12-20)28(19-29-25)31(2,3)4;1-29(2,3)26-17-27-23(16-21(26)18-9-5-4-6-10-18)19-13-14-25-22(15-19)20-11-7-8-12-24(20)28-25;3*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;/h4-17,19-22H,1-3H3;6-14,16-19H,5H2,1-4H3;4-12,14-17H,1-3H3;3*1-6,8-9H;;;/q6*-1;;;
InChIKeyNWYJEGJERCXVGC-UHFFFAOYSA-N
MW2335.14 g/mol
LogP29.51
Rot. Bonds14

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

[6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane (PubChem CID 157054415) has the molecular formula C119H100Ir3N8SSi3-6 and a molecular weight of 2335.14 g/mol. Its IUPAC name is [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane.

Molecular Properties

Compound Name[6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane
PubChem CID157054415
Molecular FormulaC119H100Ir3N8SSi3-6
Molecular Weight2335.14 g/mol
Exact Mass2335.60
IUPAC Name[6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane
SMILESCCn1c2c[c-]c(-c3cc(-c4ccccc4)c([Si](C)(C)C)cn3)cc2c2ccccc21.C[Si](C)(C)c1cnc(-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cc3sc4ccccc4c3c2)cc1-c1ccccc1.[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C32H27N2Si.C28H27N2Si.C26H22NSSi.3C11H8N.3Ir/c1-35(2,3)32-22-33-29(21-27(32)23-12-6-4-7-13-23)24-18-19-31-28(20-24)26-16-10-11-17-30(26)34(31)25-14-8-5-9-15-25;1-5-30-26-14-10-9-13-22(26)24-17-21(15-16-27(24)30)25-18-23(20-11-7-6-8-12-20)28(19-29-25)31(2,3)4;1-29(2,3)26-17-27-23(16-21(26)18-9-5-4-6-10-18)19-13-14-25-22(15-19)20-11-7-8-12-24(20)28-25;3*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;/h4-17,19-22H,1-3H3;6-14,16-19H,5H2,1-4H3;4-12,14-17H,1-3H3;3*1-6,8-9H;;;/q6*-1;;;
InChIKeyNWYJEGJERCXVGC-UHFFFAOYSA-N
XLogP29.51
TPSA87.20 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds14
Heavy Atoms134
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002335.14
LogP ≤ 529.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane with MolForge

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Related Compounds

bis(7-carbazol-9-ylspiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);bis(N,N-diphenylspiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]-7-amine);tris(platinum(2+));bis(7-(trifluoromethyl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole])
CID 160612141
2,7,12,17-Tetrakis(1-methylquinolin-1-ium-6-yl)-21,23-dithia-22,24-diazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(20),2,4,6(24),7,9,11,13(22),14,16,18-undecaene
CID 16139615
2,7,12,17-Tetrakis(1-methylquinolin-1-ium-3-yl)-21,23-dithia-22,24-diazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(20),2,4,6(24),7,9,11,13(22),14,16,18-undecaene tetrachloride
CID 16141392
2,7,12,17-Tetrakis(1-methylquinolin-1-ium-3-yl)-21,23-dithia-22,24-diazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(20),2,4,6(24),7,9,11,13(22),14,16,18-undecaene
CID 16141393
8-[3-(3-Carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine
CID 57703113
3,6-Ditert-butyl-9-[5-[2-[4-[5-(3,6-ditert-butylcarbazol-9-yl)thiophen-2-yl]-2-pyridinyl]-4-pyridinyl]thiophen-2-yl]carbazole;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;ruthenium(2+);diisothiocyanate
CID 57827859
3,6-Ditert-butyl-9-[2-[2-[4-[5-(3,6-ditert-butylcarbazol-9-yl)thieno[3,2-b]thiophen-2-yl]-2-pyridinyl]-4-pyridinyl]thieno[3,2-b]thiophen-5-yl]carbazole;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;ruthenium(2+);diisothiocyanate
CID 57827863
9-[8-[3,6-Bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzothiophen-2-yl]-3,6-bis(2-pyridin-2-ylphenyl)carbazole
CID 57958288
9-[8-[3,6-Bis(5-phenyl-3-pyridinyl)carbazol-9-yl]dibenzothiophen-2-yl]-3,6-bis(5-phenyl-3-pyridinyl)carbazole
CID 57958338
8-(3,8,13-Triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-6-[5-[6-[3-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]dibenzothiophen-2-yl]pyrido[3,2-b]indol-8-yl]-[1]benzothiolo[3,2-c]pyridine
CID 58099662
8-Carbazol-9-yl-6-[9-[6-(3-carbazol-9-ylphenyl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-c]pyridine
CID 58099706
9-[3-[4-Dibenzothiophen-4-yl-8-[3-(3-pyridin-3-ylcarbazol-9-yl)phenyl]dibenzothiophen-2-yl]phenyl]-3-pyridin-3-ylcarbazole
CID 58099752

Frequently Asked Questions

What is the IUPAC name of [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane?
The IUPAC name of [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane (CID 157054415) is [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane.
What is the SMILES notation for [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane?
The canonical SMILES for [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane is CCn1c2c[c-]c(-c3cc(-c4ccccc4)c([Si](C)(C)C)cn3)cc2c2ccccc21.C[Si](C)(C)c1cnc(-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)cc1-c1ccccc1.C[Si](C)(C)c1cnc(-c2[c-]cc3sc4ccccc4c3c2)cc1-c1ccccc1.[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.
What is the InChIKey of [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane?
The InChIKey is NWYJEGJERCXVGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H27N2Si.C28H27N2Si.C26H22NSSi.3C11H8N.3Ir/c1-35(2,3)32-22-33-29(21-27(32)23-12-6-4-7-13-23)24-18-19-31-28(20-24)26-16-10-11-17-30(26)34(31)25-14-8-5-9-15-25;1-5-30-26-14-10-9-13-22(26)24-17-21(15-16-27(24)30)25-18-23(20-11-7-6-8-12-20)28(19-29-25)31(2,3)4;1-29(2,3)26-17-27-23(16-21(26)18-9-5-4-6-10-18)19-13-14-25-22(15-19)20-11-7-8-12-24(20)28-25;3*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;/h4-17,19-22H,1-3H3;6-14,16-19H,5H2,1-4H3;4-12,14-17H,1-3H3;3*1-6,8-9H;;;/q6*-1;;;.
What are the key properties of [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane?
[6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane has a molecular weight of 2335.14 g/mol, XLogP of 29.51, 14 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3H-dibenzothiophen-3-id-2-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;[6-(9-ethyl-2H-carbazol-2-id-3-yl)-4-phenyl-3-pyridinyl]-trimethylsilane;tris(iridium);tris(2-phenylpyridine);trimethyl-[4-phenyl-6-(9-phenyl-2H-carbazol-2-id-3-yl)-3-pyridinyl]silane is sourced from PubChem (CID 157054415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).