Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum
C103H72N8Pt2Si2-2 — CID 162262965
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPACdiphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum
SMILES[2H]C([2H])([2H])n1[cH+]n(-c2[c-]c([Si](c3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4)ccn3)(c3ccccc3)c3ccccc3)ccc2)c2ccccc21.[Pt].[Pt].[c-]1c(-n2[cH+]n(-c3ccccc3)c3ccccc32)cccc1[Si](c1[c-]c2c(cc1)c1ccccc1n2-c1cc(-c2ccccc2)ccn1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C54H37N4Si.C49H35N4Si.2Pt/c1-5-18-40(19-6-1)41-34-35-55-54(36-41)58-50-29-14-13-28-48(50)49-33-32-47(38-53(49)58)59(44-23-9-3-10-24-44,45-25-11-4-12-26-45)46-27-17-22-43(37-46)57-39-56(42-20-7-2-8-21-42)51-30-15-16-31-52(51)57;1-51-35-52(47-27-14-13-26-46(47)51)38-18-15-23-41(33-38)54(39-19-7-3-8-20-39,40-21-9-4-10-22-40)42-28-29-44-43-24-11-12-25-45(43)53(48(44)34-42)49-32-37(30-31-50-49)36-16-5-2-6-17-36;;/h1-36,39H;2-32,35H,1H3;;/q2*-1;;/i;1D3;;
InChIKeyKGDBOXVHTOJTKF-LPGALAGZSA-N
MW1871.11 g/mol
LogP18.22
Rot. Bonds16
About Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum
Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum (PubChem CID 162262965) has the molecular formula C103H72N8Pt2Si2-2 and a molecular weight of 1871.11 g/mol. Its IUPAC name is diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum.
Molecular Properties
| Compound Name | Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum |
|---|---|
| PubChem CID | 162262965 |
| Molecular Formula | C103H72N8Pt2Si2-2 |
| Molecular Weight | 1871.11 g/mol |
| Exact Mass | 1869.49 |
| IUPAC Name | diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum |
| SMILES | [2H]C([2H])([2H])n1[cH+]n(-c2[c-]c([Si](c3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4)ccn3)(c3ccccc3)c3ccccc3)ccc2)c2ccccc21.[Pt].[Pt].[c-]1c(-n2[cH+]n(-c3ccccc3)c3ccccc32)cccc1[Si](c1[c-]c2c(cc1)c1ccccc1n2-c1cc(-c2ccccc2)ccn1)(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C54H37N4Si.C49H35N4Si.2Pt/c1-5-18-40(19-6-1)41-34-35-55-54(36-41)58-50-29-14-13-28-48(50)49-33-32-47(38-53(49)58)59(44-23-9-3-10-24-44,45-25-11-4-12-26-45)46-27-17-22-43(37-46)57-39-56(42-20-7-2-8-21-42)51-30-15-16-31-52(51)57;1-51-35-52(47-27-14-13-26-46(47)51)38-18-15-23-41(33-38)54(39-19-7-3-8-20-39,40-21-9-4-10-22-40)42-28-29-44-43-24-11-12-25-45(43)53(48(44)34-42)49-32-37(30-31-50-49)36-16-5-2-6-17-36;;/h1-36,39H;2-32,35H,1H3;;/q2*-1;;/i;1D3;; |
| InChIKey | KGDBOXVHTOJTKF-LPGALAGZSA-N |
| XLogP | 18.22 |
| TPSA | 55.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 115 |
| Complexity | — |
Lipinski Rule of Five
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1871.11 |
| LogP ≤ 5 | 18.22 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |
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-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum?
The IUPAC name of Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum (CID 162262965) is diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum.
What is the SMILES notation for Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum?
The canonical SMILES for Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum is [2H]C([2H])([2H])n1[cH+]n(-c2[c-]c([Si](c3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4)ccn3)(c3ccccc3)c3ccccc3)ccc2)c2ccccc21.[Pt].[Pt].[c-]1c(-n2[cH+]n(-c3ccccc3)c3ccccc32)cccc1[Si](c1[c-]c2c(cc1)c1ccccc1n2-c1cc(-c2ccccc2)ccn1)(c1ccccc1)c1ccccc1.
What is the InChIKey of Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum?
The InChIKey is KGDBOXVHTOJTKF-LPGALAGZSA-N. The full InChI is InChI=1S/C54H37N4Si.C49H35N4Si.2Pt/c1-5-18-40(19-6-1)41-34-35-55-54(36-41)58-50-29-14-13-28-48(50)49-33-32-47(38-53(49)58)59(44-23-9-3-10-24-44,45-25-11-4-12-26-45)46-27-17-22-43(37-46)57-39-56(42-20-7-2-8-21-42)51-30-15-16-31-52(51)57;1-51-35-52(47-27-14-13-26-46(47)51)38-18-15-23-41(33-38)54(39-19-7-3-8-20-39,40-21-9-4-10-22-40)42-28-29-44-43-24-11-12-25-45(43)53(48(44)34-42)49-32-37(30-31-50-49)36-16-5-2-6-17-36;;/h1-36,39H;2-32,35H,1H3;;/q2*-1;;/i;1D3;;.
What are the key properties of Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum?
Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum has a molecular weight of 1871.11 g/mol, XLogP of 18.22, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for Diphenyl-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]silane;diphenyl-[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]silane;platinum is sourced from PubChem (CID 162262965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 162262965 — identifiers, structure, computed properties (public domain)
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