diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium

C34H31P2Ru+ — CID 18503261

IUPACdiphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium
SMILES[Ru].c1cc2cc[cH-]cc-2c1.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H22P2.C9H7.Ru/c1-5-13-22(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;1-2-5-9-7-3-6-8(9)4-1;/h1-20H,21H2;1-7H;/q;-1;/p+2
InChIKeyXBQMOEBPPURHID-UHFFFAOYSA-P
MW602.64 g/mol
LogP7.18
Rot. Bonds6

About diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium

diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium (PubChem CID 18503261) has the molecular formula C34H31P2Ru+ and a molecular weight of 602.64 g/mol. Its IUPAC name is diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium.

Molecular Properties

Compound Namediphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium
PubChem CID18503261
Molecular FormulaC34H31P2Ru+
Molecular Weight602.64 g/mol
Exact Mass603.09
IUPAC Namediphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium
SMILES[Ru].c1cc2cc[cH-]cc-2c1.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H22P2.C9H7.Ru/c1-5-13-22(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;1-2-5-9-7-3-6-8(9)4-1;/h1-20H,21H2;1-7H;/q;-1;/p+2
InChIKeyXBQMOEBPPURHID-UHFFFAOYSA-P
XLogP7.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500602.64
LogP ≤ 57.18
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'}

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Related Compounds

carbon monoxide;5H-inden-5-ide;manganese
CID 12585434
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CID 42620755
carbanide;diphenylphosphaniumylmethyl(diphenyl)phosphanium;methanone;rhenium;ruthenium(3+)
CID 162398575
3,4-dimethylhexa-2,4-diene;bis(5H-inden-5-ide);zirconium
CID 18503420
bis(acetonitrile);bis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);ruthenium(2+)
CID 6390174
1,1'-biphenyl;triphenylphosphanium;hydroxide
CID 18407779
azulene;phosphane
CID 175448344
cyclopenta-1,3-diene;3-cyclopenta-1,4-dien-1-ylbenzoic acid;iron(2+)
CID 50918245
benzene;tris(1,1'-biphenyl)
CID 162155747
cyclopenta-1,3-diene;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;ethene;iron(6+)
CID 11987308
cyclopenta-1,4-dien-1-ylbenzene;dichloro(dimethylsilylidene)zirconium;1,2,4-trimethylcyclopenta-1,3-diene
CID 154419852
bis(9H-anthracen-9-ide);diphenylphosphaniumylmethyl(diphenyl)phosphanium;bis(gold(1+))
CID 162499550

Frequently Asked Questions

What is the IUPAC name of diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium?
The IUPAC name of diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium (CID 18503261) is diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium.
What is the SMILES notation for diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium?
The canonical SMILES for diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium is [Ru].c1cc2cc[cH-]cc-2c1.c1ccc([PH+](C[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium?
The InChIKey is XBQMOEBPPURHID-UHFFFAOYSA-P. The full InChI is InChI=1S/C25H22P2.C9H7.Ru/c1-5-13-22(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;1-2-5-9-7-3-6-8(9)4-1;/h1-20H,21H2;1-7H;/q;-1;/p+2.
What are the key properties of diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium?
diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium has a molecular weight of 602.64 g/mol, XLogP of 7.18, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylphosphaniumylmethyl(diphenyl)phosphanium;5H-inden-5-ide;ruthenium is sourced from PubChem (CID 18503261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).