diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate)

C38H18F24N2O16Rh4Si — CID 139133010

IUPACdiphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate)
SMILESO=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.[Rh+2].[Rh+2].[Rh+2].[Rh+2].c1ccc([Si](c2ccccc2)(c2ccncc2)c2ccncc2)cc1
InChIInChI=1S/C22H18N2Si.8C2HF3O2.4Rh/c1-3-7-19(8-4-1)25(20-9-5-2-6-10-20,21-11-15-23-16-12-21)22-13-17-24-18-14-22;8*3-2(4,5)1(6)7;;;;/h1-18H;8*(H,6,7);;;;/q;;;;;;;;;4*+2/p-8
InChIKeySPEYZGDWOLZGOV-UHFFFAOYSA-F
MW1654.22 g/mol
LogP-3.77
Rot. Bonds4

About diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate)

diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate) (PubChem CID 139133010) has the molecular formula C38H18F24N2O16Rh4Si and a molecular weight of 1654.22 g/mol. Its IUPAC name is diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate).

Molecular Properties

Compound Namediphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate)
PubChem CID139133010
Molecular FormulaC38H18F24N2O16Rh4Si
Molecular Weight1654.22 g/mol
Exact Mass1653.63
IUPAC Namediphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate)
SMILESO=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.[Rh+2].[Rh+2].[Rh+2].[Rh+2].c1ccc([Si](c2ccccc2)(c2ccncc2)c2ccncc2)cc1
InChIInChI=1S/C22H18N2Si.8C2HF3O2.4Rh/c1-3-7-19(8-4-1)25(20-9-5-2-6-10-20,21-11-15-23-16-12-21)22-13-17-24-18-14-22;8*3-2(4,5)1(6)7;;;;/h1-18H;8*(H,6,7);;;;/q;;;;;;;;;4*+2/p-8
InChIKeySPEYZGDWOLZGOV-UHFFFAOYSA-F
XLogP-3.77
TPSA346.82 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds4
Heavy Atoms85
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001654.22
LogP ≤ 5-3.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

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Related Compounds

phenylphosphanium;2,2,2-trifluoroacetate
CID 162300055
5-triphenylsilylbenzene-1,3-dicarboxylic acid
CID 19797757
bis(4-methylphenyl)-phenylsulfanium;2,2,2-trifluoroacetate
CID 172792663
zinc 2,2,2-trifluoroacetate
CID 22604677
magnesium bis(2,2,2-trifluoroacetate)
CID 11139550
samarium;bis(2,2,2-trifluoroacetate)
CID 22462012
sodium 2,2,2-trifluoroacetate
CID 517019
sodium (E)-1,1,1-trifluoro-4-oxo-4-pyridin-4-ylbut-2-en-2-olate
CID 23688301
triphenylsilyl 2-(trifluoromethyl)prop-2-enoate
CID 163794375
2,2,2-trifluoroacetate;triphenyl-(4,4,4-trifluoro-2-methyl-3-oxobutan-2-yl)phosphanium
CID 10097977
bicyclo[2.2.0]hexa-1,3,5-triene;diphenyl(thiophen-2-yl)sulfanium;2,2,2-trifluoroacetate
CID 87247828
2,2,3,3-tetrafluorobutanedioate;bis(triphenylsulfanium)
CID 87756710

Frequently Asked Questions

What is the IUPAC name of diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate)?
The IUPAC name of diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate) (CID 139133010) is diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate).
What is the SMILES notation for diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate)?
The canonical SMILES for diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate) is O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.[Rh+2].[Rh+2].[Rh+2].[Rh+2].c1ccc([Si](c2ccccc2)(c2ccncc2)c2ccncc2)cc1.
What is the InChIKey of diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate)?
The InChIKey is SPEYZGDWOLZGOV-UHFFFAOYSA-F. The full InChI is InChI=1S/C22H18N2Si.8C2HF3O2.4Rh/c1-3-7-19(8-4-1)25(20-9-5-2-6-10-20,21-11-15-23-16-12-21)22-13-17-24-18-14-22;8*3-2(4,5)1(6)7;;;;/h1-18H;8*(H,6,7);;;;/q;;;;;;;;;4*+2/p-8.
What are the key properties of diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate)?
diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate) has a molecular weight of 1654.22 g/mol, XLogP of -3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl(dipyridin-4-yl)silane;tetrakis(rhodium(2+));octakis(2,2,2-trifluoroacetate) is sourced from PubChem (CID 139133010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).