bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+)

C74H50N4PtSi2 — CID 59661705

About bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+)

bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+) (PubChem CID 59661705) has the molecular formula C74H50N4PtSi2 and a molecular weight of 1246.49 g/mol. Its IUPAC name is bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+).

Molecular Properties

• Compound Name: bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+)
• PubChem CID: 59661705
• Molecular Formula: C74H50N4PtSi2
• Molecular Weight: 1246.49 g/mol
• Exact Mass: 1245.32
• IUPAC Name: bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+)
• SMILES: Cc1ccc2c(c1)c1cc(C)ccc1n2-c1c[c-]c2c(c1)[Si]1(c3ccccc3-c3ccccc31)c1cccnc1-2.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1c[c-]c2c(c1)[Si]1(c3ccccc3-c3ccccc31)c1cccnc1-2.[Pt+2]
• InChI: InChI=1S/2C37H25N2Si.Pt/c2*1-23-13-17-31-29(20-23)30-21-24(2)14-18-32(30)39(31)25-15-16-28-36(22-25)40(35-12-7-19-38-37(28)35)33-10-5-3-8-26(33)27-9-4-6-11-34(27)40;/h2*3-15,17-22H,1-2H3;/q2*-1;+2
• InChIKey: XBRDLQGRAVFYJO-UHFFFAOYSA-N
• XLogP: 11.87
• TPSA: 35.64 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 2
• Heavy Atoms: 81
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1246.49
LogP ≤ 5	11.87
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+)?

The IUPAC name of bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+) (CID 59661705) is bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+).

What is the SMILES notation for bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+)?

The canonical SMILES for bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+) is Cc1ccc2c(c1)c1cc(C)ccc1n2-c1c[c-]c2c(c1)[Si]1(c3ccccc3-c3ccccc31)c1cccnc1-2.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1c[c-]c2c(c1)[Si]1(c3ccccc3-c3ccccc31)c1cccnc1-2.[Pt+2].

What is the InChIKey of bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+)?

The InChIKey is XBRDLQGRAVFYJO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C37H25N2Si.Pt/c2*1-23-13-17-31-29(20-23)30-21-24(2)14-18-32(30)39(31)25-15-16-28-36(22-25)40(35-12-7-19-38-37(28)35)33-10-5-3-8-26(33)27-9-4-6-11-34(27)40;/h2*3-15,17-22H,1-2H3;/q2*-1;+2.

What are the key properties of bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+)?

bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+) has a molecular weight of 1246.49 g/mol, XLogP of 11.87, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for bis(7-(3,6-dimethylcarbazol-9-yl)spiro[9H-[1]benzosilolo[3,2-b]pyridin-9-ide-5,5'-benzo[b][1]benzosilole]);platinum(2+) is sourced from PubChem (CID 59661705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).