bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate

C20H16N6O6Pd2+2 — CID 122164920

IUPACbis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].[Pd+2].[Pd+2].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/2C10H8N2.2NO3.2Pd/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*2-1(3)4;;/h2*1-8H;;;;/q;;2*-1;2*+2
InChIKeyKWUJNMGVRQAAMG-UHFFFAOYSA-N
MW649.22 g/mol
LogP3.80
Rot. Bonds2

About bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate

bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate (PubChem CID 122164920) has the molecular formula C20H16N6O6Pd2+2 and a molecular weight of 649.22 g/mol. Its IUPAC name is bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate.

Molecular Properties

Compound Namebis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate
PubChem CID122164920
Molecular FormulaC20H16N6O6Pd2+2
Molecular Weight649.22 g/mol
Exact Mass647.92
IUPAC Namebis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].[Pd+2].[Pd+2].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/2C10H8N2.2NO3.2Pd/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*2-1(3)4;;/h2*1-8H;;;;/q;;2*-1;2*+2
InChIKeyKWUJNMGVRQAAMG-UHFFFAOYSA-N
XLogP3.80
TPSA183.96 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500649.22
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Tris(2,2a(2)-bipyridyl)dichlororuthenium(II) hexahydrate
CID 165340051
Tris(2,2'-bipyridine)nickel dichloride
CID 72193962
tris(2,2'-bipyridyl)dichlororuthenium(II) hexahydrate
CID 172897992
tris(2,2'-bipyridine)iron(II)
CID 6857601
tris(2,2'-bipyridine)ruthenium(II)
CID 44176403
Tris(2,2'-bipyridyl)ruthenium(II) dichloride
CID 44140593
Cobalt(2+);2-pyridin-2-yl-6-[3-(6-pyridin-2-yl-2-pyridinyl)propyl]pyridine;bis(trifluoromethanesulfonate)
CID 139042189
Bis(bis(trifluoromethylsulfonyl)azanide);bis(2,6-dipyridin-2-ylpyridine);bis(palladium(2+));dinitrate
CID 139149293
Gold;bis(2-pyridin-2-ylpyridine);dihydrate
CID 71593220
Iridium;bis(2-phenylpyridine);2-pyridin-2-ylpyridine
CID 59773775
cis-Dichlorobis(2,2'-dipyridyl)rhodium(III) chloride
CID 129896657
Tris(2,2'-bipyridyl-N,N')iron(II) diperchlorate
CID 139057872

Frequently Asked Questions

What is the IUPAC name of bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate?
The IUPAC name of bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate (CID 122164920) is bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate.
What is the SMILES notation for bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate?
The canonical SMILES for bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate is O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Pd+2].[Pd+2].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate?
The InChIKey is KWUJNMGVRQAAMG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H8N2.2NO3.2Pd/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*2-1(3)4;;/h2*1-8H;;;;/q;;2*-1;2*+2.
What are the key properties of bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate?
bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate has a molecular weight of 649.22 g/mol, XLogP of 3.80, 2 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for bis(palladium(2+));bis(2-pyridin-2-ylpyridine);dinitrate is sourced from PubChem (CID 122164920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).