10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium

C43H34AuClNP2+ — CID 170514866

IUPAC10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium
SMILESCl[Au].[c-]1cccc2ccc3cccnc3c12.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C30H24P2.C13H8N.Au.ClH/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;;/h1-24H;1-5,7-9H;;1H/q;-1;+1;/p+1
InChIKeySDKZRJDTRBBRBR-UHFFFAOYSA-O
MW859.12 g/mol
LogP8.54
Rot. Bonds6

About 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium

10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium (PubChem CID 170514866) has the molecular formula C43H34AuClNP2+ and a molecular weight of 859.12 g/mol. Its IUPAC name is 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium.

Molecular Properties

Compound Name10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium
PubChem CID170514866
Molecular FormulaC43H34AuClNP2+
Molecular Weight859.12 g/mol
Exact Mass858.15
IUPAC Name10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium
SMILESCl[Au].[c-]1cccc2ccc3cccnc3c12.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C30H24P2.C13H8N.Au.ClH/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;;/h1-24H;1-5,7-9H;;1H/q;-1;+1;/p+1
InChIKeySDKZRJDTRBBRBR-UHFFFAOYSA-O
XLogP8.54
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500859.12
LogP ≤ 58.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium with MolForge

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Related Compounds

beryllium bis(10H-benzo[h]quinolin-10-ide)
CID 156697230
carbon monoxide;chlororhenium;1,10-phenanthroline;triphenylphosphanium
CID 158659159
bis(10H-benzo[h]quinolin-10-ide);iridium;10-methylbenzo[h]quinoline
CID 59480620
bis(10H-benzo[h]quinolin-10-ide);bis(palladium);diacetate;difluoride
CID 53470521
silver;10H-benzo[h]quinolin-10-ide;2-fluorobenzoic acid
CID 155643179
bis(10H-benzo[h]quinolin-10-ide);iridium(3+);10-methanidylbenzo[h]quinoline
CID 58084663
iridium(3+);bis(12H-phenanthro[9,10-b]pyridin-12-ide);1,10-phenanthroline;chloride
CID 54741035
10H-benzo[h]quinolin-10-ide;2-pyridin-2-ylphenol;quinolin-8-ol;rhenium
CID 135973441
10H-benzo[h]quinolin-10-ide;iridium;4-methyl-5-phenyl-2-phenylpyridine
CID 140719052
10H-benzo[h]quinolin-10-ide;ethane;tris(iridium);2-phenylpyridine;2-(3H-thiophen-3-id-2-yl)pyridine
CID 158596255
bis(10H-benzo[h]quinolin-10-ide);tetrakis(iridium(3+));bis(2-(4-methylbenzene-6-id-1-yl)pyridine);octakis(2-phenylpyridine)
CID 157371936
10H-benzo[h]quinolin-10-ide;4-phenylimidazo[1,2-a]benzimidazole;platinum(2+)
CID 153419309

Frequently Asked Questions

What is the IUPAC name of 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium?
The IUPAC name of 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium (CID 170514866) is 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium.
What is the SMILES notation for 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium?
The canonical SMILES for 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium is Cl[Au].[c-]1cccc2ccc3cccnc3c12.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium?
The InChIKey is SDKZRJDTRBBRBR-UHFFFAOYSA-O. The full InChI is InChI=1S/C30H24P2.C13H8N.Au.ClH/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;;/h1-24H;1-5,7-9H;;1H/q;-1;+1;/p+1.
What are the key properties of 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium?
10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium has a molecular weight of 859.12 g/mol, XLogP of 8.54, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10H-benzo[h]quinolin-10-ide;chlorogold;(2-diphenylphosphaniumylphenyl)-diphenylphosphanium is sourced from PubChem (CID 170514866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).