2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)

C74H48N2Pt — CID 167327911

About 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)

2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) (PubChem CID 167327911) has the molecular formula C74H48N2Pt and a molecular weight of 1160.29 g/mol. Its IUPAC name is 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+).

Molecular Properties

• Compound Name: 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)
• PubChem CID: 167327911
• Molecular Formula: C74H48N2Pt
• Molecular Weight: 1160.29 g/mol
• Exact Mass: 1159.35
• IUPAC Name: 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)
• SMILES: [Pt+2].[c-]1c(C(=C(c2cccc(-c3ccccc3)c2)c2cccc(-c3ccccc3)c2)c2[c-]c(C3(c4ccccn4)c4ccccc4-c4ccccc43)ccc2)cccc1C1(c2ccccn2)c2ccccc2-c2ccccc21
• InChI: InChI=1S/C74H48N2.Pt/c1-3-23-51(24-4-1)53-27-19-29-55(47-53)71(56-30-20-28-54(48-56)52-25-5-2-6-26-52)72(57-31-21-33-59(49-57)73(69-43-15-17-45-75-69)65-39-11-7-35-61(65)62-36-8-12-40-66(62)73)58-32-22-34-60(50-58)74(70-44-16-18-46-76-70)67-41-13-9-37-63(67)64-38-10-14-42-68(64)74;/h1-48H;/q-2;+2
• InChIKey: WQMQEAAPUFGRMT-UHFFFAOYSA-N
• XLogP: 17.14
• TPSA: 25.78 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 10
• Heavy Atoms: 77
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1160.29
LogP ≤ 5	17.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)?

The IUPAC name of 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) (CID 167327911) is 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+).

What is the SMILES notation for 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)?

The canonical SMILES for 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) is [Pt+2].[c-]1c(C(=C(c2cccc(-c3ccccc3)c2)c2cccc(-c3ccccc3)c2)c2[c-]c(C3(c4ccccn4)c4ccccc4-c4ccccc43)ccc2)cccc1C1(c2ccccn2)c2ccccc2-c2ccccc21.

What is the InChIKey of 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)?

The InChIKey is WQMQEAAPUFGRMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H48N2.Pt/c1-3-23-51(24-4-1)53-27-19-29-55(47-53)71(56-30-20-28-54(48-56)52-25-5-2-6-26-52)72(57-31-21-33-59(49-57)73(69-43-15-17-45-75-69)65-39-11-7-35-61(65)62-36-8-12-40-66(62)73)58-32-22-34-60(50-58)74(70-44-16-18-46-76-70)67-41-13-9-37-63(67)64-38-10-14-42-68(64)74;/h1-48H;/q-2;+2.

What are the key properties of 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)?

2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) has a molecular weight of 1160.29 g/mol, XLogP of 17.14, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[9-[3-[2,2-bis(3-phenylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) is sourced from PubChem (CID 167327911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).