[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium)

C86H67F6Ir5N10O5Si3-5 — CID 160846855

IUPAC[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium)
SMILESC[Si](C)(C)c1ccn(-c2[c-]ccc3c2oc2ccccc23)n1.C[Si](C)(C)c1ccnn1-c1[c-]ccc2c1oc1ccccc12.C[Si](C)(C)c1cnn(-c2[c-]ccc3c2oc2ccccc23)c1.FC(F)(F)c1ccn(-c2[c-]ccc3c2oc2ccccc23)n1.FC(F)(F)c1ccnn1-c1[c-]ccc2c1oc1ccccc12.[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/3C18H17N2OSi.2C16H8F3N2O.5Ir/c1-22(2,3)13-11-19-20(12-13)16-9-6-8-15-14-7-4-5-10-17(14)21-18(15)16;1-22(2,3)17-11-12-20(19-17)15-9-6-8-14-13-7-4-5-10-16(13)21-18(14)15;1-22(2,3)17-11-12-19-20(17)15-9-6-8-14-13-7-4-5-10-16(13)21-18(14)15;17-16(18,19)14-8-9-21(20-14)12-6-3-5-11-10-4-1-2-7-13(10)22-15(11)12;17-16(18,19)14-8-9-20-21(14)12-6-3-5-11-10-4-1-2-7-13(10)22-15(11)12;;;;;/h3*4-8,10-12H,1-3H3;2*1-5,7-9H;;;;;/q5*-1;;;;;
InChIKeyCNSRJWWHINMDIS-UHFFFAOYSA-N
MW2479.88 g/mol
LogP21.52
Rot. Bonds8

About [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium)

[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium) (PubChem CID 160846855) has the molecular formula C86H67F6Ir5N10O5Si3-5 and a molecular weight of 2479.88 g/mol. Its IUPAC name is [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium).

Molecular Properties

Compound Name[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium)
PubChem CID160846855
Molecular FormulaC86H67F6Ir5N10O5Si3-5
Molecular Weight2479.88 g/mol
Exact Mass2482.27
IUPAC Name[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium)
SMILESC[Si](C)(C)c1ccn(-c2[c-]ccc3c2oc2ccccc23)n1.C[Si](C)(C)c1ccnn1-c1[c-]ccc2c1oc1ccccc12.C[Si](C)(C)c1cnn(-c2[c-]ccc3c2oc2ccccc23)c1.FC(F)(F)c1ccn(-c2[c-]ccc3c2oc2ccccc23)n1.FC(F)(F)c1ccnn1-c1[c-]ccc2c1oc1ccccc12.[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/3C18H17N2OSi.2C16H8F3N2O.5Ir/c1-22(2,3)13-11-19-20(12-13)16-9-6-8-15-14-7-4-5-10-17(14)21-18(15)16;1-22(2,3)17-11-12-20(19-17)15-9-6-8-14-13-7-4-5-10-16(13)21-18(14)15;1-22(2,3)17-11-12-19-20(17)15-9-6-8-14-13-7-4-5-10-16(13)21-18(14)15;17-16(18,19)14-8-9-21(20-14)12-6-3-5-11-10-4-1-2-7-13(10)22-15(11)12;17-16(18,19)14-8-9-20-21(14)12-6-3-5-11-10-4-1-2-7-13(10)22-15(11)12;;;;;/h3*4-8,10-12H,1-3H3;2*1-5,7-9H;;;;;/q5*-1;;;;;
InChIKeyCNSRJWWHINMDIS-UHFFFAOYSA-N
XLogP21.52
TPSA154.80 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds8
Heavy Atoms115
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002479.88
LogP ≤ 521.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

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

Analyze [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium) with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium)?
The IUPAC name of [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium) (CID 160846855) is [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium).
What is the SMILES notation for [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium)?
The canonical SMILES for [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium) is C[Si](C)(C)c1ccn(-c2[c-]ccc3c2oc2ccccc23)n1.C[Si](C)(C)c1ccnn1-c1[c-]ccc2c1oc1ccccc12.C[Si](C)(C)c1cnn(-c2[c-]ccc3c2oc2ccccc23)c1.FC(F)(F)c1ccn(-c2[c-]ccc3c2oc2ccccc23)n1.FC(F)(F)c1ccnn1-c1[c-]ccc2c1oc1ccccc12.[Ir].[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium)?
The InChIKey is CNSRJWWHINMDIS-UHFFFAOYSA-N. The full InChI is InChI=1S/3C18H17N2OSi.2C16H8F3N2O.5Ir/c1-22(2,3)13-11-19-20(12-13)16-9-6-8-15-14-7-4-5-10-17(14)21-18(15)16;1-22(2,3)17-11-12-20(19-17)15-9-6-8-14-13-7-4-5-10-16(13)21-18(14)15;1-22(2,3)17-11-12-19-20(17)15-9-6-8-14-13-7-4-5-10-16(13)21-18(14)15;17-16(18,19)14-8-9-21(20-14)12-6-3-5-11-10-4-1-2-7-13(10)22-15(11)12;17-16(18,19)14-8-9-20-21(14)12-6-3-5-11-10-4-1-2-7-13(10)22-15(11)12;;;;;/h3*4-8,10-12H,1-3H3;2*1-5,7-9H;;;;;/q5*-1;;;;;.
What are the key properties of [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium)?
[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium) has a molecular weight of 2479.88 g/mol, XLogP of 21.52, 8 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-4-yl]-trimethylsilane;[2-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]-trimethylsilane;1-(3H-dibenzofuran-3-id-4-yl)-3-(trifluoromethyl)pyrazole;1-(3H-dibenzofuran-3-id-4-yl)-5-(trifluoromethyl)pyrazole;pentakis(iridium) is sourced from PubChem (CID 160846855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).