9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum

C68H50N6OPt-2 — CID 160755738

About 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum

9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum (PubChem CID 160755738) has the molecular formula C68H50N6OPt-2 and a molecular weight of 1162.27 g/mol. Its IUPAC name is 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum.

Molecular Properties

• Compound Name: 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum
• PubChem CID: 160755738
• Molecular Formula: C68H50N6OPt-2
• Molecular Weight: 1162.27 g/mol
• Exact Mass: 1161.37
• IUPAC Name: 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum
• SMILES: C.C.Cc1nnc(-c2[c-]c(Oc3[c-]c(-n4[c-][n+](-c5c(-n6c7ccccc7c7ccccc76)cccc5-n5c6ccccc6c6ccccc65)c5ccccc54)ccc3)ccc2)cc1-c1ccc(-c2ccccc2)cc1.[Pt]
• InChI: InChI=1S/C66H42N6O.2CH4.Pt/c1-44-56(47-38-36-46(37-39-47)45-18-3-2-4-19-45)42-57(68-67-44)48-20-15-22-50(40-48)73-51-23-16-21-49(41-51)69-43-70(63-33-14-13-32-62(63)69)66-64(71-58-28-9-5-24-52(58)53-25-6-10-29-59(53)71)34-17-35-65(66)72-60-30-11-7-26-54(60)55-27-8-12-31-61(55)72;;;/h2-39,42H,1H3;2*1H4;/q-2
• InChIKey: FWWGCPIDXYDASX-UHFFFAOYSA-N
• XLogP: 16.66
• TPSA: 53.68 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 9
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1162.27
LogP ≤ 5	16.66
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum?

The IUPAC name of 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum (CID 160755738) is 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum.

What is the SMILES notation for 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum?

The canonical SMILES for 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum is C.C.Cc1nnc(-c2[c-]c(Oc3[c-]c(-n4[c-][n+](-c5c(-n6c7ccccc7c7ccccc76)cccc5-n5c6ccccc6c6ccccc65)c5ccccc54)ccc3)ccc2)cc1-c1ccc(-c2ccccc2)cc1.[Pt].

What is the InChIKey of 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum?

The InChIKey is FWWGCPIDXYDASX-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H42N6O.2CH4.Pt/c1-44-56(47-38-36-46(37-39-47)45-18-3-2-4-19-45)42-57(68-67-44)48-20-15-22-50(40-48)73-51-23-16-21-49(41-51)69-43-70(63-33-14-13-32-62(63)69)66-64(71-58-28-9-5-24-52(58)53-25-6-10-29-59(53)71)34-17-35-65(66)72-60-30-11-7-26-54(60)55-27-8-12-31-61(55)72;;;/h2-39,42H,1H3;2*1H4;/q-2;;;.

What are the key properties of 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum?

9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum has a molecular weight of 1162.27 g/mol, XLogP of 16.66, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[3-carbazol-9-yl-2-[3-[3-[3-[6-methyl-5-(4-phenylphenyl)pyridazin-3-yl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-benzimidazol-1-ium-2-id-1-yl]phenyl]carbazole;methane;platinum is sourced from PubChem (CID 160755738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).