bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate

C38H57F12P5Rh2-2 — CID 171369767

IUPACbis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate
SMILESC1CC2CCC1C2.C1CC2CCC1C2.CP(C)c1ccccc1.CP(C)c1ccccc1.CP(C)c1ccccc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Rh].[Rh]
InChIInChI=1S/3C8H11P.2C7H12.2F6P.2Rh/c3*1-9(2)8-6-4-3-5-7-8;2*1-2-7-4-3-6(1)5-7;2*1-7(2,3,4,5)6;;/h3*3-7H,1-2H3;2*6-7H,1-5H2;;;;/q;;;;;2*-1;;
InChIKeyOJVVDAOQRXKKLA-UHFFFAOYSA-N
MW1102.53 g/mol
LogP17.31
Rot. Bonds3

About bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate

bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate (PubChem CID 171369767) has the molecular formula C38H57F12P5Rh2-2 and a molecular weight of 1102.53 g/mol. Its IUPAC name is bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate.

Molecular Properties

Compound Namebis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate
PubChem CID171369767
Molecular FormulaC38H57F12P5Rh2-2
Molecular Weight1102.53 g/mol
Exact Mass1102.11
IUPAC Namebis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate
SMILESC1CC2CCC1C2.C1CC2CCC1C2.CP(C)c1ccccc1.CP(C)c1ccccc1.CP(C)c1ccccc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Rh].[Rh]
InChIInChI=1S/3C8H11P.2C7H12.2F6P.2Rh/c3*1-9(2)8-6-4-3-5-7-8;2*1-2-7-4-3-6(1)5-7;2*1-7(2,3,4,5)6;;/h3*3-7H,1-2H3;2*6-7H,1-5H2;;;;/q;;;;;2*-1;;
InChIKeyOJVVDAOQRXKKLA-UHFFFAOYSA-N
XLogP17.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001102.53
LogP ≤ 517.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate?
The IUPAC name of bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate (CID 171369767) is bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate.
What is the SMILES notation for bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate?
The canonical SMILES for bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate is C1CC2CCC1C2.C1CC2CCC1C2.CP(C)c1ccccc1.CP(C)c1ccccc1.CP(C)c1ccccc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Rh].[Rh].
What is the InChIKey of bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate?
The InChIKey is OJVVDAOQRXKKLA-UHFFFAOYSA-N. The full InChI is InChI=1S/3C8H11P.2C7H12.2F6P.2Rh/c3*1-9(2)8-6-4-3-5-7-8;2*1-2-7-4-3-6(1)5-7;2*1-7(2,3,4,5)6;;/h3*3-7H,1-2H3;2*6-7H,1-5H2;;;;/q;;;;;2*-1;;.
What are the key properties of bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate?
bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate has a molecular weight of 1102.53 g/mol, XLogP of 17.31, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(bicyclo[2.2.1]heptane);tris(dimethyl(phenyl)phosphane);bis(rhodium);dihexafluorophosphate is sourced from PubChem (CID 171369767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).