2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum

C61H42N3Pt-3 — CID 176592361

About 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum

2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum (PubChem CID 176592361) has the molecular formula C61H42N3Pt-3 and a molecular weight of 1012.11 g/mol. Its IUPAC name is 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum.

Molecular Properties

• Compound Name: 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum
• PubChem CID: 176592361
• Molecular Formula: C61H42N3Pt-3
• Molecular Weight: 1012.11 g/mol
• Exact Mass: 1011.30
• IUPAC Name: 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum
• SMILES: CC1=CN(C2(c3[c-]c(C4(c5[c-]c(C6(c7ccccn7)c7ccccc7-c7ccccc76)ccc5)c5ccccc5-c5ccccc54)ccc3)c3ccccc3-c3ccccc32)[CH-]N1C.[Pt]
• InChI: InChI=1S/C61H42N3.Pt/c1-41-39-64(40-63(41)2)61(56-33-13-7-27-50(56)51-28-8-14-34-57(51)61)45-22-18-20-43(38-45)59(52-29-9-3-23-46(52)47-24-4-10-30-53(47)59)42-19-17-21-44(37-42)60(58-35-15-16-36-62-58)54-31-11-5-25-48(54)49-26-6-12-32-55(49)60;/h3-36,39-40H,1-2H3;/q-3
• InChIKey: DXQGDFWVZZAYAR-UHFFFAOYSA-N
• XLogP: 12.91
• TPSA: 19.37 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 6
• Heavy Atoms: 65
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1012.11
LogP ≤ 5	12.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum?

The IUPAC name of 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum (CID 176592361) is 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum.

What is the SMILES notation for 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum?

The canonical SMILES for 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum is CC1=CN(C2(c3[c-]c(C4(c5[c-]c(C6(c7ccccn7)c7ccccc7-c7ccccc76)ccc5)c5ccccc5-c5ccccc54)ccc3)c3ccccc3-c3ccccc32)[CH-]N1C.[Pt].

What is the InChIKey of 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum?

The InChIKey is DXQGDFWVZZAYAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H42N3.Pt/c1-41-39-64(40-63(41)2)61(56-33-13-7-27-50(56)51-28-8-14-34-57(51)61)45-22-18-20-43(38-45)59(52-29-9-3-23-46(52)47-24-4-10-30-53(47)59)42-19-17-21-44(37-42)60(58-35-15-16-36-62-58)54-31-11-5-25-48(54)49-26-6-12-32-55(49)60;/h3-36,39-40H,1-2H3;/q-3;.

What are the key properties of 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum?

2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum has a molecular weight of 1012.11 g/mol, XLogP of 12.91, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[9-[3-[9-[3-[9-(3,4-dimethyl-2H-imidazol-2-id-1-yl)fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum is sourced from PubChem (CID 176592361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).