3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole

C102H77Ir5N13OPtS2-6 — CID 160864746

About 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole

3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole (PubChem CID 160864746) has the molecular formula C102H77Ir5N13OPtS2-6 and a molecular weight of 2721.12 g/mol. Its IUPAC name is 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole.

Molecular Properties

• Compound Name: 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole
• PubChem CID: 160864746
• Molecular Formula: C102H77Ir5N13OPtS2-6
• Molecular Weight: 2721.12 g/mol
• Exact Mass: 2723.36
• IUPAC Name: 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole
• SMILES: C=Cc1ccc(-n2ccc(-c3[c-]ccc(-c4ccccn4)c3)n2)cc1.CC1(C)c2ccccc2-c2c[c-]c(-c3cscn3)cc21.Cn1ccc(-c2[c-]cc3c(c2)C(C)(C)c2ccccc2-3)n1.Cn1ccc(-c2[c-]ccc(-c3ccccc3)c2)n1.[Ir].[Ir].[Ir].[Ir].[Ir].[Pt].[c-]1ccc(-c2ccccc2)cc1-c1ncon1.[c-]1ccc(-c2ccccn2)cc1-c1ncsn1
• InChI: InChI=1S/C22H16N3.C19H17N2.C18H14NS.C16H13N2.C14H9N2O.C13H8N3S.5Ir.Pt/c1-2-17-9-11-20(12-10-17)25-15-13-22(24-25)19-7-5-6-18(16-19)21-8-3-4-14-23-21;1-19(2)16-7-5-4-6-14(16)15-9-8-13(12-17(15)19)18-10-11-21(3)20-18;1-18(2)15-6-4-3-5-13(15)14-8-7-12(9-16(14)18)17-10-20-11-19-17;1-18-11-10-16(17-18)15-9-5-8-14(12-15)13-6-3-2-4-7-13;1-2-5-11(6-3-1)12-7-4-8-13(9-12)14-15-10-17-16-14;1-2-7-14-12(6-1)10-4-3-5-11(8-10)13-15-9-17-16-13;;;;;;/h2-6,8-16H,1H2;4-7,9-12H,1-3H3;3-6,8-11H,1-2H3;2-8,10-12H,1H3;1-7,9-10H;1-4,6-9H;;;;;;/q6*-1
• InChIKey: FBMBLAUPHQDYHL-UHFFFAOYSA-N
• XLogP: 23.97
• TPSA: 156.83 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 12
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2721.12
LogP ≤ 5	23.97
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole?

The IUPAC name of 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole (CID 160864746) is 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole.

What is the SMILES notation for 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole?

The canonical SMILES for 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole is C=Cc1ccc(-n2ccc(-c3[c-]ccc(-c4ccccn4)c3)n2)cc1.CC1(C)c2ccccc2-c2c[c-]c(-c3cscn3)cc21.Cn1ccc(-c2[c-]cc3c(c2)C(C)(C)c2ccccc2-3)n1.Cn1ccc(-c2[c-]ccc(-c3ccccc3)c2)n1.[Ir].[Ir].[Ir].[Ir].[Ir].[Pt].[c-]1ccc(-c2ccccc2)cc1-c1ncon1.[c-]1ccc(-c2ccccn2)cc1-c1ncsn1.

What is the InChIKey of 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole?

The InChIKey is FBMBLAUPHQDYHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N3.C19H17N2.C18H14NS.C16H13N2.C14H9N2O.C13H8N3S.5Ir.Pt/c1-2-17-9-11-20(12-10-17)25-15-13-22(24-25)19-7-5-6-18(16-19)21-8-3-4-14-23-21;1-19(2)16-7-5-4-6-14(16)15-9-8-13(12-17(15)19)18-10-11-21(3)20-18;1-18(2)15-6-4-3-5-13(15)14-8-7-12(9-16(14)18)17-10-20-11-19-17;1-18-11-10-16(17-18)15-9-5-8-14(12-15)13-6-3-2-4-7-13;1-2-5-11(6-3-1)12-7-4-8-13(9-12)14-15-10-17-16-14;1-2-7-14-12(6-1)10-4-3-5-11(8-10)13-15-9-17-16-13;;;;;;/h2-6,8-16H,1H2;4-7,9-12H,1-3H3;3-6,8-11H,1-2H3;2-8,10-12H,1H3;1-7,9-10H;1-4,6-9H;;;;;;/q6*-1;;;;;;.

What are the key properties of 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole?

3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole has a molecular weight of 2721.12 g/mol, XLogP of 23.97, 12 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1-methylpyrazole;4-(9,9-dimethyl-3H-fluoren-3-id-2-yl)-1,3-thiazole;2-[3-[1-(4-ethenylphenyl)pyrazol-3-yl]benzene-4-id-1-yl]pyridine;pentakis(iridium);1-methyl-3-(3-phenylbenzene-6-id-1-yl)pyrazole;3-(3-phenylbenzene-6-id-1-yl)-1,2,4-oxadiazole;platinum;3-(3-pyridin-2-ylbenzene-6-id-1-yl)-1,2,4-thiadiazole is sourced from PubChem (CID 160864746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).