[1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum

C55H45N5OPtSi-2 — CID 166497131

About [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum

[1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum (PubChem CID 166497131) has the molecular formula C55H45N5OPtSi-2 and a molecular weight of 1015.16 g/mol. Its IUPAC name is [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum.

Molecular Properties

• Compound Name: [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum
• PubChem CID: 166497131
• Molecular Formula: C55H45N5OPtSi-2
• Molecular Weight: 1015.16 g/mol
• Exact Mass: 1014.31
• IUPAC Name: [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum
• SMILES: CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[c-][n+](-c6c([Si](C)(C)C)ccc7c8ccccc8n(-c8ccccc8)c67)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[Pt]
• InChI: InChI=1S/C55H45N5OSi.Pt/c1-55(2,3)37-31-32-56-52(33-37)60-47-24-13-10-21-42(47)44-28-27-41(35-50(44)60)61-40-20-16-19-39(34-40)57-36-58(49-26-15-14-25-48(49)57)54-51(62(4,5)6)30-29-45-43-22-11-12-23-46(43)59(53(45)54)38-17-8-7-9-18-38;/h7-33H,1-6H3;/q-2
• InChIKey: ZIZOKFBVELAGAY-UHFFFAOYSA-N
• XLogP: 12.53
• TPSA: 40.79 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 63
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1015.16
LogP ≤ 5	12.53
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum?

The IUPAC name of [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum (CID 166497131) is [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum.

What is the SMILES notation for [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum?

The canonical SMILES for [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum is CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[c-][n+](-c6c([Si](C)(C)C)ccc7c8ccccc8n(-c8ccccc8)c67)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[Pt].

What is the InChIKey of [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum?

The InChIKey is ZIZOKFBVELAGAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H45N5OSi.Pt/c1-55(2,3)37-31-32-56-52(33-37)60-47-24-13-10-21-42(47)44-28-27-41(35-50(44)60)61-40-20-16-19-39(34-40)57-36-58(49-26-15-14-25-48(49)57)54-51(62(4,5)6)30-29-45-43-22-11-12-23-46(43)59(53(45)54)38-17-8-7-9-18-38;/h7-33H,1-6H3;/q-2;.

What are the key properties of [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum?

[1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum has a molecular weight of 1015.16 g/mol, XLogP of 12.53, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for [1-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]-9-phenylcarbazol-2-yl]-trimethylsilane;platinum is sourced from PubChem (CID 166497131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).