9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum

C125H100N17Pt3-9 — CID 159218104

About 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum

9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum (PubChem CID 159218104) has the molecular formula C125H100N17Pt3-9 and a molecular weight of 2425.53 g/mol. Its IUPAC name is 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum
• PubChem CID: 159218104
• Molecular Formula: C125H100N17Pt3-9
• Molecular Weight: 2425.53 g/mol
• Exact Mass: 2423.73
• IUPAC Name: 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum
• SMILES: CN1[CH-]N(c2[c-]c(-n3c4[c-]c(-n5cccn5)ccc4c4ccccc43)cc(C(C)(C)C)c2)C=C1n1c2ccccc2c2ccccc21.CN1[CH-]N(c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccccn3)cc(C(C)(C)C)c2)C=C1n1c2ccccc2c2ccccc21.CN1[CH-]N(c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-n3cccn3)cc(C(C)(C)C)c2)C=C1n1c2ccccc2c2ccccc21.[Pt].[Pt].[Pt]
• InChI: InChI=1S/C43H34N5.2C41H33N6.3Pt/c1-43(2,3)30-23-29(37-16-11-12-22-44-37)24-32(25-30)47-38-17-8-5-15-35(38)36-21-20-31(26-41(36)47)46-27-42(45(4)28-46)48-39-18-9-6-13-33(39)34-14-7-10-19-40(34)48;1-41(2,3)28-22-30(44-26-40(43(4)27-44)47-37-16-9-6-12-32(37)33-13-7-10-17-38(33)47)24-31(23-28)46-36-15-8-5-14-34(36)35-19-18-29(25-39(35)46)45-21-11-20-42-45;1-41(2,3)28-22-30(45-21-11-20-42-45)24-31(23-28)46-36-15-8-5-14-34(36)35-19-18-29(25-39(35)46)44-26-40(43(4)27-44)47-37-16-9-6-12-32(37)33-13-7-10-17-38(33)47;;;/h5-23,25,27-28H,1-4H3;2*5-23,26-27H,1-4H3;;;/q3*-3
• InChIKey: REWLGSGGAASTEY-UHFFFAOYSA-N
• XLogP: 28.78
• TPSA: 97.55 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 12
• Heavy Atoms: 145
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2425.53
LogP ≤ 5	28.78
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum (CID 159218104) is 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum?

The canonical SMILES for 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum is CN1[CH-]N(c2[c-]c(-n3c4[c-]c(-n5cccn5)ccc4c4ccccc43)cc(C(C)(C)C)c2)C=C1n1c2ccccc2c2ccccc21.CN1[CH-]N(c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccccn3)cc(C(C)(C)C)c2)C=C1n1c2ccccc2c2ccccc21.CN1[CH-]N(c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-n3cccn3)cc(C(C)(C)C)c2)C=C1n1c2ccccc2c2ccccc21.[Pt].[Pt].[Pt].

What is the InChIKey of 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum?

The InChIKey is REWLGSGGAASTEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H34N5.2C41H33N6.3Pt/c1-43(2,3)30-23-29(37-16-11-12-22-44-37)24-32(25-30)47-38-17-8-5-15-35(38)36-21-20-31(26-41(36)47)46-27-42(45(4)28-46)48-39-18-9-6-13-33(39)34-14-7-10-19-40(34)48;1-41(2,3)28-22-30(44-26-40(43(4)27-44)47-37-16-9-6-12-32(37)33-13-7-10-17-38(33)47)24-31(23-28)46-36-15-8-5-14-34(36)35-19-18-29(25-39(35)46)45-21-11-20-42-45;1-41(2,3)28-22-30(45-21-11-20-42-45)24-31(23-28)46-36-15-8-5-14-34(36)35-19-18-29(25-39(35)46)44-26-40(43(4)27-44)47-37-16-9-6-12-32(37)33-13-7-10-17-38(33)47;;;/h5-23,25,27-28H,1-4H3;2*5-23,26-27H,1-4H3;;;/q3*-3;;;.

What are the key properties of 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum?

9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum has a molecular weight of 2425.53 g/mol, XLogP of 28.78, 12 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[3-tert-butyl-5-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2-pyrazol-1-yl-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyrazol-1-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;9-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 159218104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).