[2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane

C87H79Ir4N5O3S2Si4-4 — CID 157324329

IUPAC[2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane
SMILESC[Si](C)(C)c1cccnc1-c1[c-]cc2sc3ccccc3c2c1.C[Si](C)(C)c1ccnc(-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c1.C[Si](C)(C)c1ccnc(-c2[c-]cc3oc4ccccc4c3c2)c1.Cc1cc(-c2[c-]cc3c(c2)-c2ccccc2S3(=O)=O)ncc1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C26H23N2Si.C21H20NO2SSi.C20H18NOSi.C20H18NSSi.4Ir/c1-29(2,3)21-15-16-27-24(18-21)19-13-14-26-23(17-19)22-11-7-8-12-25(22)28(26)20-9-5-4-6-10-20;1-14-11-18(22-13-21(14)26(2,3)4)15-9-10-20-17(12-15)16-7-5-6-8-19(16)25(20,23)24;1-23(2,3)15-10-11-21-18(13-15)14-8-9-20-17(12-14)16-6-4-5-7-19(16)22-20;1-23(2,3)19-9-6-12-21-20(19)14-10-11-18-16(13-14)15-7-4-5-8-17(15)22-18;;;;/h4-12,14-18H,1-3H3;5-8,10-13H,1-4H3;4-7,9-13H,1-3H3;4-9,11-13H,1-3H3;;;;/q4*-1;;;;
InChIKeyMDMNAAWSMHRUET-UHFFFAOYSA-N
MW2187.97 g/mol
LogP20.85
Rot. Bonds9

About [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane

[2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane (PubChem CID 157324329) has the molecular formula C87H79Ir4N5O3S2Si4-4 and a molecular weight of 2187.97 g/mol. Its IUPAC name is [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane.

Molecular Properties

Compound Name[2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane
PubChem CID157324329
Molecular FormulaC87H79Ir4N5O3S2Si4-4
Molecular Weight2187.97 g/mol
Exact Mass2189.32
IUPAC Name[2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane
SMILESC[Si](C)(C)c1cccnc1-c1[c-]cc2sc3ccccc3c2c1.C[Si](C)(C)c1ccnc(-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c1.C[Si](C)(C)c1ccnc(-c2[c-]cc3oc4ccccc4c3c2)c1.Cc1cc(-c2[c-]cc3c(c2)-c2ccccc2S3(=O)=O)ncc1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C26H23N2Si.C21H20NO2SSi.C20H18NOSi.C20H18NSSi.4Ir/c1-29(2,3)21-15-16-27-24(18-21)19-13-14-26-23(17-19)22-11-7-8-12-25(22)28(26)20-9-5-4-6-10-20;1-14-11-18(22-13-21(14)26(2,3)4)15-9-10-20-17(12-15)16-7-5-6-8-19(16)25(20,23)24;1-23(2,3)15-10-11-21-18(13-15)14-8-9-20-17(12-14)16-6-4-5-7-19(16)22-20;1-23(2,3)19-9-6-12-21-20(19)14-10-11-18-16(13-14)15-7-4-5-8-17(15)22-18;;;;/h4-12,14-18H,1-3H3;5-8,10-13H,1-4H3;4-7,9-13H,1-3H3;4-9,11-13H,1-3H3;;;;/q4*-1;;;;
InChIKeyMDMNAAWSMHRUET-UHFFFAOYSA-N
XLogP20.85
TPSA103.77 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds9
Heavy Atoms105
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002187.97
LogP ≤ 520.85
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 [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane with MolForge

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Related Compounds

[7-[Bis(4-fluorophenyl)-methylidene-lambda5-phosphanyl]dibenzofuran-3-yl]-bis(4-fluorophenyl)-methylidene-lambda5-phosphane;[7-[bis(4-fluorophenyl)-methylidene-lambda5-phosphanyl]-9-phenylcarbazol-2-yl]-bis(4-fluorophenyl)-methylidene-lambda5-phosphane;[6-[5-[bis(4-fluorophenyl)-methylidene-lambda5-phosphanyl]-2-pyridinyl]-3-pyridinyl]-bis(4-fluorophenyl)-methylidene-lambda5-phosphane;methylidene-[7-[methylidene-bis(4-methylphenyl)-lambda5-phosphanyl]dibenzothiophen-3-yl]-bis[4-(trifluoromethyl)phenyl]-lambda5-phosphane;methylidene-[7-[methylidene-bis(4-methylphenyl)-lambda5-phosphanyl]-9-phenylcarbazol-2-yl]-bis[4-(trifluoromethyl)phenyl]-lambda5-phosphane
CID 157655597
tetrakis([6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane);ethanol;iridium;iridium(3+);methanol;2-phenylpyridine;2-phenylpyridine;trifluoromethanesulfonic acid
CID 158458529
8-[3-[6-[6-[6-[3-(4,8,12-Triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]dibenzofuran-4-yl]dibenzothiophen-4-yl]dibenzofuran-4-yl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58059133
9-Phenyl-3-(2-pyridin-2-ylphenyl)-6-[8-[2-[8-(2-pyridin-2-ylphenyl)dibenzofuran-2-yl]dibenzothiophen-4-yl]dibenzofuran-2-yl]carbazole
CID 58059180
8-[[6-([1]Benzothiolo[3,2-c]pyridin-8-yloxymethyl)-2,8-bis[4-[(4-carbazol-9-yl-2-pyridinyl)methyl]-2,6-dimethylphenyl]dibenzofuran-4-yl]methoxy]-[1]benzothiolo[3,2-c]pyridine
CID 58501578
8-[3-[8-[4,6-Dimethyl-8-[3-(5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]dibenzofuran-2-yl]-4,6-dimethyldibenzothiophen-2-yl]phenyl]-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58501587
[9-([1]Benzothiolo[3,2-c]pyridin-8-yl)carbazol-3-yl]-dibenzofuran-4-yl-dimethylsilane
CID 89850204
8-[3-[8-[9-(9-Phenylcarbazol-3-yl)carbazol-3-yl]dibenzofuran-2-yl]carbazol-9-yl]-[1]benzothiolo[3,2-b]pyridine
CID 89850230
8-[3-[9-([1]Benzothiolo[3,2-c]pyridin-8-yl)carbazol-3-yl]sulfonylcarbazol-9-yl]-[1]benzofuro[3,2-c]pyridine
CID 89850247
8-[3-(9-Dibenzofuran-2-ylcarbazol-3-yl)sulfinylcarbazol-9-yl]-[1]benzothiolo[3,2-c]pyridine
CID 89850248
8-[6-(5,7-Diphenylindolo[2,3-b]carbazol-2-yl)-8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-[1]benzothiolo[3,2-c]pyridine
CID 118700105
5-[8-(1-Benzothiophen-2-yl)dibenzofuran-2-yl]-1-methylindole;2,8-bis(5-thiophen-2-ylthiophen-2-yl)dibenzofuran
CID 123292338

Frequently Asked Questions

What is the IUPAC name of [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane?
The IUPAC name of [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane (CID 157324329) is [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane.
What is the SMILES notation for [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane?
The canonical SMILES for [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane is C[Si](C)(C)c1cccnc1-c1[c-]cc2sc3ccccc3c2c1.C[Si](C)(C)c1ccnc(-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c1.C[Si](C)(C)c1ccnc(-c2[c-]cc3oc4ccccc4c3c2)c1.Cc1cc(-c2[c-]cc3c(c2)-c2ccccc2S3(=O)=O)ncc1[Si](C)(C)C.[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane?
The InChIKey is MDMNAAWSMHRUET-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N2Si.C21H20NO2SSi.C20H18NOSi.C20H18NSSi.4Ir/c1-29(2,3)21-15-16-27-24(18-21)19-13-14-26-23(17-19)22-11-7-8-12-25(22)28(26)20-9-5-4-6-10-20;1-14-11-18(22-13-21(14)26(2,3)4)15-9-10-20-17(12-15)16-7-5-6-8-19(16)25(20,23)24;1-23(2,3)15-10-11-21-18(13-15)14-8-9-20-17(12-14)16-6-4-5-7-19(16)22-20;1-23(2,3)19-9-6-12-21-20(19)14-10-11-18-16(13-14)15-7-4-5-8-17(15)22-18;;;;/h4-12,14-18H,1-3H3;5-8,10-13H,1-4H3;4-7,9-13H,1-3H3;4-9,11-13H,1-3H3;;;;/q4*-1;;;;.
What are the key properties of [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane?
[2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane has a molecular weight of 2187.97 g/mol, XLogP of 20.85, 9 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3H-dibenzofuran-3-id-2-yl)-4-pyridinyl]-trimethylsilane;[2-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(5,5-dioxo-3H-dibenzothiophen-3-id-2-yl)-4-methyl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[2-(9-phenyl-2H-carbazol-2-id-3-yl)-4-pyridinyl]silane is sourced from PubChem (CID 157324329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).