(3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+))

C66H56Au2P2Si2+2 — CID 164789976

About (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+))

(3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+)) (PubChem CID 164789976) has the molecular formula C66H56Au2P2Si2+2 and a molecular weight of 1361.23 g/mol. Its IUPAC name is (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+)).

Molecular Properties

• Compound Name: (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+))
• PubChem CID: 164789976
• Molecular Formula: C66H56Au2P2Si2+2
• Molecular Weight: 1361.23 g/mol
• Exact Mass: 1360.27
• IUPAC Name: (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+))
• SMILES: [Au+].[Au+].[C-]#Cc1ccc2c(c1)-c1ccccc1[Si]2(C)C.[H]/[C-]=C\c1ccc2c(c1)[Si](C)(C)c1ccccc1-2.c1ccc([PH+](c2ccccc2)c2cc3ccccc3cc2[PH+](c2ccccc2)c2ccccc2)cc1
• InChI: InChI=1S/C34H26P2.C16H13Si.C16H15Si.2Au/c1-5-17-29(18-6-1)35(30-19-7-2-8-20-30)33-25-27-15-13-14-16-28(27)26-34(33)36(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-4-12-9-10-16-14(11-12)13-7-5-6-8-15(13)17(16,2)3;1-4-12-9-10-14-13-7-5-6-8-15(13)17(2,3)16(14)11-12;;/h1-26H;5-11H,2-3H3;1,4-11H,2-3H3;;/q;2*-1;2*+1/p+2
• InChIKey: IURYDCDWNGPMNW-UHFFFAOYSA-P
• XLogP: 11.18
• TPSA: 0.00 Ų
• Rotatable Bonds: 7
• Heavy Atoms: 72
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1361.23
LogP ≤ 5	11.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+))?

The IUPAC name of (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+)) (CID 164789976) is (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+)).

What is the SMILES notation for (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+))?

The canonical SMILES for (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+)) is [Au+].[Au+].[C-]#Cc1ccc2c(c1)-c1ccccc1[Si]2(C)C.[H]/[C-]=C\c1ccc2c(c1)[Si](C)(C)c1ccccc1-2.c1ccc([PH+](c2ccccc2)c2cc3ccccc3cc2[PH+](c2ccccc2)c2ccccc2)cc1.

What is the InChIKey of (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+))?

The InChIKey is IURYDCDWNGPMNW-UHFFFAOYSA-P. The full InChI is InChI=1S/C34H26P2.C16H13Si.C16H15Si.2Au/c1-5-17-29(18-6-1)35(30-19-7-2-8-20-30)33-25-27-15-13-14-16-28(27)26-34(33)36(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-4-12-9-10-16-14(11-12)13-7-5-6-8-15(13)17(16,2)3;1-4-12-9-10-14-13-7-5-6-8-15(13)17(2,3)16(14)11-12;;/h1-26H;5-11H,2-3H3;1,4-11H,2-3H3;;/q;2*-1;2*+1/p+2.

What are the key properties of (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+))?

(3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+)) has a molecular weight of 1361.23 g/mol, XLogP of 11.18, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for (3-diphenylphosphaniumylnaphthalen-2-yl)-diphenylphosphanium;3-ethenyl-5,5-dimethylbenzo[b][1]benzosilole;2-ethynyl-5,5-dimethylbenzo[b][1]benzosilole;bis(gold(1+)) is sourced from PubChem (CID 164789976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).