1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum

C70H52N6PtSi-2 — CID 177128909

About 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum

1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum (PubChem CID 177128909) has the molecular formula C70H52N6PtSi-2 and a molecular weight of 1210.45 g/mol. Its IUPAC name is 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum.

Molecular Properties

• Compound Name: 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum
• PubChem CID: 177128909
• Molecular Formula: C70H52N6PtSi-2
• Molecular Weight: 1210.45 g/mol
• Exact Mass: 1209.43
• IUPAC Name: 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum
• SMILES: [2H]c1c([2H])c([2H])c(-c2cccc(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2-[n+]2[c-]n(-c3[c-]c(N4c5[c-]c6c(cc5N(c5ccccc5)[Si]4(c4ccccc4)c4ccccc4)c4ccccc4n6-c4cc(C(C)(C)C)ccn4)ccc3)c3ccccc32)c([2H])c1[2H].[Pt]
• InChI: InChI=1S/C70H52N6Si.Pt/c1-70(2,3)52-43-44-71-68(45-52)74-62-40-20-19-37-60(62)61-47-66-67(48-65(61)74)76(77(56-33-15-7-16-34-56,57-35-17-8-18-36-57)75(66)53-29-13-6-14-30-53)55-32-23-31-54(46-55)72-49-73(64-42-22-21-41-63(64)72)69-58(50-25-9-4-10-26-50)38-24-39-59(69)51-27-11-5-12-28-51;/h4-45,47H,1-3H3;/q-2;/i4D,5D,9D,10D,11D,12D,25D,26D,27D,28D
• InChIKey: FWMBSEORBUBSMN-PNDUICBQSA-N
• XLogP: 14.98
• TPSA: 33.11 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 78
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1210.45
LogP ≤ 5	14.98
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-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum?

The IUPAC name of 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum (CID 177128909) is 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum.

What is the SMILES notation for 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum?

The canonical SMILES for 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum is [2H]c1c([2H])c([2H])c(-c2cccc(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2-[n+]2[c-]n(-c3[c-]c(N4c5[c-]c6c(cc5N(c5ccccc5)[Si]4(c4ccccc4)c4ccccc4)c4ccccc4n6-c4cc(C(C)(C)C)ccn4)ccc3)c3ccccc32)c([2H])c1[2H].[Pt].

What is the InChIKey of 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum?

The InChIKey is FWMBSEORBUBSMN-PNDUICBQSA-N. The full InChI is InChI=1S/C70H52N6Si.Pt/c1-70(2,3)52-43-44-71-68(45-52)74-62-40-20-19-37-60(62)61-47-66-67(48-65(61)74)76(77(56-33-15-7-16-34-56,57-35-17-8-18-36-57)75(66)53-29-13-6-14-30-53)55-32-23-31-54(46-55)72-49-73(64-42-22-21-41-63(64)72)69-58(50-25-9-4-10-26-50)38-24-39-59(69)51-27-11-5-12-28-51;/h4-45,47H,1-3H3;/q-2;/i4D,5D,9D,10D,11D,12D,25D,26D,27D,28D;.

What are the key properties of 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum?

1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum has a molecular weight of 1210.45 g/mol, XLogP of 14.98, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]-9-(4-tert-butyl-2-pyridinyl)-2,2,3-triphenyl-10H-[1,3,2]diazasilolo[4,5-b]carbazol-10-ide;platinum is sourced from PubChem (CID 177128909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).