palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate

C24H16F12N4P2Pd — CID 46192367

IUPACpalladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate
SMILESF[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Pd+2].c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
InChIInChI=1S/2C12H8N2.2F6P.Pd/c2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2*1-7(2,3,4,5)6;/h2*1-8H;;;/q;;2*-1;+2
InChIKeySPRLLEYDPGIKKF-UHFFFAOYSA-N
MW756.76 g/mol
LogP12.33
Rot. Bonds

About palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate

palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate (PubChem CID 46192367) has the molecular formula C24H16F12N4P2Pd and a molecular weight of 756.76 g/mol. Its IUPAC name is palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate.

Molecular Properties

Compound Namepalladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate
PubChem CID46192367
Molecular FormulaC24H16F12N4P2Pd
Molecular Weight756.76 g/mol
Exact Mass755.97
IUPAC Namepalladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate
SMILESF[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Pd+2].c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
InChIInChI=1S/2C12H8N2.2F6P.Pd/c2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2*1-7(2,3,4,5)6;/h2*1-8H;;;/q;;2*-1;+2
InChIKeySPRLLEYDPGIKKF-UHFFFAOYSA-N
XLogP12.33
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500756.76
LogP ≤ 512.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1,10-Phenanthroline
CID 1318
4,7-Diphenyl-1,10-phenanthroline
CID 72812
1,10-Phenanthroline hydrate
CID 21226
4,7-Dimethyl-1,10-phenanthroline
CID 72792
3,4,7,8-Tetramethyl-1,10-phenanthroline
CID 74265
4-Methyl-1,10-phenanthroline
CID 93149
2-Methyl-1,10-phenanthroline
CID 4913356
2,3-Dipyridyl-6,7-dimethylquinoxaline
CID 81109
1,10-Phenanthroline monohydrochloride monohydrate
CID 2723715
1,10-Phenanthroline hydrochloride
CID 73350
3-Methyl-1,10-phenanthroline
CID 15783796
1,10-Phenanthroline ferrous sulfate
CID 84567

Frequently Asked Questions

What is the IUPAC name of palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate?
The IUPAC name of palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate (CID 46192367) is palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate.
What is the SMILES notation for palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate?
The canonical SMILES for palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate is F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Pd+2].c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.
What is the InChIKey of palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate?
The InChIKey is SPRLLEYDPGIKKF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H8N2.2F6P.Pd/c2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2*1-7(2,3,4,5)6;/h2*1-8H;;;/q;;2*-1;+2.
What are the key properties of palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate?
palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate has a molecular weight of 756.76 g/mol, XLogP of 12.33, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for palladium(2+);bis(1,10-phenanthroline);dihexafluorophosphate is sourced from PubChem (CID 46192367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).