9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

C73H47N4OPt-3 — CID 172545748

About 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (PubChem CID 172545748) has the molecular formula C73H47N4OPt-3 and a molecular weight of 1191.28 g/mol. Its IUPAC name is 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• PubChem CID: 172545748
• Molecular Formula: C73H47N4OPt-3
• Molecular Weight: 1191.28 g/mol
• Exact Mass: 1190.34
• IUPAC Name: 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• SMILES: [Pt].[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C3(c4ccccc4)c4ccccc4-c4ccccc43)ccn2)cccc1N1[CH-]N(c2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)c2ccccc21
• InChI: InChI=1S/C73H47N4O.Pt/c1-5-22-50(23-6-1)53-44-63(51-24-7-2-8-25-51)72(64(45-53)52-26-9-3-10-27-52)76-49-75(68-38-19-20-39-69(68)76)56-30-21-31-57(47-56)78-58-40-41-62-61-34-15-18-37-67(61)77(70(62)48-58)71-46-55(42-43-74-71)73(54-28-11-4-12-29-54)65-35-16-13-32-59(65)60-33-14-17-36-66(60)73;/h1-46,49H;/q-3
• InChIKey: CSAGWODKTHWQKW-UHFFFAOYSA-N
• XLogP: 18.34
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 79
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1191.28
LogP ≤ 5	18.34
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The IUPAC name of 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (CID 172545748) is 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The canonical SMILES for 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is [Pt].[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C3(c4ccccc4)c4ccccc4-c4ccccc43)ccn2)cccc1N1[CH-]N(c2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)c2ccccc21.

What is the InChIKey of 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The InChIKey is CSAGWODKTHWQKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H47N4O.Pt/c1-5-22-50(23-6-1)53-44-63(51-24-7-2-8-25-51)72(64(45-53)52-26-9-3-10-27-52)76-49-75(68-38-19-20-39-69(68)76)56-30-21-31-57(47-56)78-58-40-41-62-61-34-15-18-37-67(61)77(70(62)48-58)71-46-55(42-43-74-71)73(54-28-11-4-12-29-54)65-35-16-13-32-59(65)60-33-14-17-36-66(60)73;/h1-46,49H;/q-3;.

What are the key properties of 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum has a molecular weight of 1191.28 g/mol, XLogP of 18.34, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[4-(9-phenylfluoren-9-yl)-2-pyridinyl]-2-[3-[3-(2,4,6-triphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 172545748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).