disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+))

C118H100Ag2Au2P4+4 — CID 164978762

IUPACdisilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+))
SMILES[Ag+].[Ag+].[Au+].[Au+].[C-]#Cc1ccc2c(c1)-c1ccccc1C2(C)C.[C-]#Cc1ccc2c(c1)C(C)(C)c1ccccc1-2.[C-]#Cc1cccc2c1-c1ccccc1C2(C)C.[C-]#Cc1cccc2c1-c1ccccc1C2(C)C.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C25H22P2.4C17H13.2Ag.2Au/c2*1-5-13-22(14-6-1)26(23-15-7-2-8-16-23)21-27(24-17-9-3-10-18-24)25-19-11-4-12-20-25;2*1-4-12-8-7-11-15-16(12)13-9-5-6-10-14(13)17(15,2)3;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;;;;/h2*1-20H,21H2;4*5-11H,2-3H3;;;;/q;;4*-1;4*+1/p+4
InChIKeyVJZUQTHZZIZENO-UHFFFAOYSA-R
MW2251.66 g/mol
LogP25.06
Rot. Bonds12

About disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+))

disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+)) (PubChem CID 164978762) has the molecular formula C118H100Ag2Au2P4+4 and a molecular weight of 2251.66 g/mol. Its IUPAC name is disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+)).

Molecular Properties

Compound Namedisilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+))
PubChem CID164978762
Molecular FormulaC118H100Ag2Au2P4+4
Molecular Weight2251.66 g/mol
Exact Mass2248.42
IUPAC Namedisilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+))
SMILES[Ag+].[Ag+].[Au+].[Au+].[C-]#Cc1ccc2c(c1)-c1ccccc1C2(C)C.[C-]#Cc1ccc2c(c1)C(C)(C)c1ccccc1-2.[C-]#Cc1cccc2c1-c1ccccc1C2(C)C.[C-]#Cc1cccc2c1-c1ccccc1C2(C)C.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C25H22P2.4C17H13.2Ag.2Au/c2*1-5-13-22(14-6-1)26(23-15-7-2-8-16-23)21-27(24-17-9-3-10-18-24)25-19-11-4-12-20-25;2*1-4-12-8-7-11-15-16(12)13-9-5-6-10-14(13)17(15,2)3;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;;;;/h2*1-20H,21H2;4*5-11H,2-3H3;;;;/q;;4*-1;4*+1/p+4
InChIKeyVJZUQTHZZIZENO-UHFFFAOYSA-R
XLogP25.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms126
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002251.66
LogP ≤ 525.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+))?
The IUPAC name of disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+)) (CID 164978762) is disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+)).
What is the SMILES notation for disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+))?
The canonical SMILES for disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+)) is [Ag+].[Ag+].[Au+].[Au+].[C-]#Cc1ccc2c(c1)-c1ccccc1C2(C)C.[C-]#Cc1ccc2c(c1)C(C)(C)c1ccccc1-2.[C-]#Cc1cccc2c1-c1ccccc1C2(C)C.[C-]#Cc1cccc2c1-c1ccccc1C2(C)C.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+))?
The InChIKey is VJZUQTHZZIZENO-UHFFFAOYSA-R. The full InChI is InChI=1S/2C25H22P2.4C17H13.2Ag.2Au/c2*1-5-13-22(14-6-1)26(23-15-7-2-8-16-23)21-27(24-17-9-3-10-18-24)25-19-11-4-12-20-25;2*1-4-12-8-7-11-15-16(12)13-9-5-6-10-14(13)17(15,2)3;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;;;;/h2*1-20H,21H2;4*5-11H,2-3H3;;;;/q;;4*-1;4*+1/p+4.
What are the key properties of disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+))?
disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+)) has a molecular weight of 2251.66 g/mol, XLogP of 25.06, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);2-ethynyl-9,9-dimethylfluorene;3-ethynyl-9,9-dimethylfluorene;bis(4-ethynyl-9,9-dimethylfluorene);bis(gold(1+)) is sourced from PubChem (CID 164978762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).