diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+)

C60H42N4PtSi — CID 167382420

About diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+)

diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+) (PubChem CID 167382420) has the molecular formula C60H42N4PtSi and a molecular weight of 1042.19 g/mol. Its IUPAC name is diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+).

Molecular Properties

• Compound Name: diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+)
• PubChem CID: 167382420
• Molecular Formula: C60H42N4PtSi
• Molecular Weight: 1042.19 g/mol
• Exact Mass: 1041.28
• IUPAC Name: diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+)
• SMILES: [Pt+2].[c-]1c(N2CN(c3ccccc3)c3ccccc32)cccc1[Si](c1[c-]c2c(cc1)c1ccccc1n2-c1cc(-c2ccccc2-c2ccccc2)ccn1)(c1ccccc1)c1ccccc1
• InChI: InChI=1S/C60H42N4Si.Pt/c1-5-20-44(21-6-1)52-30-13-14-31-53(52)45-38-39-61-60(40-45)64-56-33-16-15-32-54(56)55-37-36-51(42-59(55)64)65(48-25-9-3-10-26-48,49-27-11-4-12-28-49)50-29-19-24-47(41-50)63-43-62(46-22-7-2-8-23-46)57-34-17-18-35-58(57)63;/h1-40H,43H2;/q-2;+2
• InChIKey: ZCUUJZIZXCPHJB-UHFFFAOYSA-N
• XLogP: 11.74
• TPSA: 24.30 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1042.19
LogP ≤ 5	11.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+)?

The IUPAC name of diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+) (CID 167382420) is diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+).

What is the SMILES notation for diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+)?

The canonical SMILES for diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+) is [Pt+2].[c-]1c(N2CN(c3ccccc3)c3ccccc32)cccc1[Si](c1[c-]c2c(cc1)c1ccccc1n2-c1cc(-c2ccccc2-c2ccccc2)ccn1)(c1ccccc1)c1ccccc1.

What is the InChIKey of diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+)?

The InChIKey is ZCUUJZIZXCPHJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H42N4Si.Pt/c1-5-20-44(21-6-1)52-30-13-14-31-53(52)45-38-39-61-60(40-45)64-56-33-16-15-32-54(56)55-37-36-51(42-59(55)64)65(48-25-9-3-10-26-48,49-27-11-4-12-28-49)50-29-19-24-47(41-50)63-43-62(46-22-7-2-8-23-46)57-34-17-18-35-58(57)63;/h1-40H,43H2;/q-2;+2.

What are the key properties of diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+)?

diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+) has a molecular weight of 1042.19 g/mol, XLogP of 11.74, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for diphenyl-[3-(3-phenyl-2H-benzimidazol-1-yl)benzene-2-id-1-yl]-[9-[4-(2-phenylphenyl)-2-pyridinyl]-1H-carbazol-1-id-2-yl]silane;platinum(2+) is sourced from PubChem (CID 167382420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).