bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide)

C42H32F2N8Pt2-6 — CID 176622038

About bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide)

bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide) (PubChem CID 176622038) has the molecular formula C42H32F2N8Pt2-6 and a molecular weight of 1076.93 g/mol. Its IUPAC name is bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide).

Molecular Properties

• Compound Name: bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide)
• PubChem CID: 176622038
• Molecular Formula: C42H32F2N8Pt2-6
• Molecular Weight: 1076.93 g/mol
• Exact Mass: 1076.20
• IUPAC Name: bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide)
• SMILES: CN1C=CN(c2[c-]cc(F)cc2)[CH-]1.CN1C=CN(c2[c-]cc(F)cc2)[CH-]1.[Pt].[Pt].c1ccc2c(c1)[n-]c1ncccc12.c1ccc2c(c1)[n-]c1ncccc12
• InChI: InChI=1S/2C11H7N2.2C10H9FN2.2Pt/c2*1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10;2*1-12-6-7-13(8-12)10-4-2-9(11)3-5-10;;/h2*1-7H;2*2-4,6-8H,1H3;;/q2*-1;2*-2
• InChIKey: DNHVTAREPBUXEK-UHFFFAOYSA-N
• XLogP: 8.62
• TPSA: 66.94 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 2
• Heavy Atoms: 54
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1076.93
LogP ≤ 5	8.62
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide)?

The IUPAC name of bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide) (CID 176622038) is bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide).

What is the SMILES notation for bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide)?

The canonical SMILES for bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide) is CN1C=CN(c2[c-]cc(F)cc2)[CH-]1.CN1C=CN(c2[c-]cc(F)cc2)[CH-]1.[Pt].[Pt].c1ccc2c(c1)[n-]c1ncccc12.c1ccc2c(c1)[n-]c1ncccc12.

What is the InChIKey of bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide)?

The InChIKey is DNHVTAREPBUXEK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H7N2.2C10H9FN2.2Pt/c2*1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10;2*1-12-6-7-13(8-12)10-4-2-9(11)3-5-10;;/h2*1-7H;2*2-4,6-8H,1H3;;/q2*-1;2*-2;;.

What are the key properties of bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide)?

bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide) has a molecular weight of 1076.93 g/mol, XLogP of 8.62, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for bis(1-(4-fluorobenzene-6-id-1-yl)-3-methyl-2H-imidazol-2-ide);platinum;bis(pyrido[2,3-b]indol-9-ide) is sourced from PubChem (CID 176622038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).