[1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+)

C56H44N2P2Pd+2 — CID 146164742

IUPAC[1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+)
SMILES[NH-]c1ccc2ccccc2c1-c1c([NH-])ccc2ccccc12.[Pd+2].c1ccc([PH+](c2ccccc2)c2ccccc2-c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C36H28P2.C20H14N2.Pd/c1-5-17-29(18-6-1)37(30-19-7-2-8-20-30)35-27-15-13-25-33(35)34-26-14-16-28-36(34)38(31-21-9-3-10-22-31)32-23-11-4-12-24-32;21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22;/h1-28H;1-12,21-22H;/q;-2;+2/p+2
InChIKeyUSZLDDCKILKWSF-UHFFFAOYSA-P
MW913.35 g/mol
LogP13.36
Rot. Bonds8

About [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+)

[1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+) (PubChem CID 146164742) has the molecular formula C56H44N2P2Pd+2 and a molecular weight of 913.35 g/mol. Its IUPAC name is [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+).

Molecular Properties

Compound Name[1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+)
PubChem CID146164742
Molecular FormulaC56H44N2P2Pd+2
Molecular Weight913.35 g/mol
Exact Mass912.20
IUPAC Name[1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+)
SMILES[NH-]c1ccc2ccccc2c1-c1c([NH-])ccc2ccccc12.[Pd+2].c1ccc([PH+](c2ccccc2)c2ccccc2-c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C36H28P2.C20H14N2.Pd/c1-5-17-29(18-6-1)37(30-19-7-2-8-20-30)35-27-15-13-25-33(35)34-26-14-16-28-36(34)38(31-21-9-3-10-22-31)32-23-11-4-12-24-32;21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22;/h1-28H;1-12,21-22H;/q;-2;+2/p+2
InChIKeyUSZLDDCKILKWSF-UHFFFAOYSA-P
XLogP13.36
TPSA47.60 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500913.35
LogP ≤ 513.36
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

[1-(2-diphenylphosphaniumylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphanium;palladium(2+)
CID 134943742
nonacyclo[30.8.0.02,11.03,8.012,21.015,20.022,31.023,28.035,40]tetraconta-1(32),2(11),3,5,7,9,12(21),13,15,17,19,22(31),23,25,27,29,33,35,37,39-icosaene
CID 15525083
bis(acetonitrile);[1-(2-diphenylphosphaniumylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphanium;palladium(2+);bis(trifluoromethanesulfonic acid)
CID 158996959
1,2-diphenylnaphthalene
CID 11208267
benzo[c]fluoren-7-one
CID 22413
12,24-dinaphthalen-1-ylhexacyclo[11.11.0.02,11.05,10.014,23.017,22]tetracosa-1(24),2(11),3,5,7,9,12,14(23),15,17,19,21-dodecaene
CID 123249303
1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
CID 59169251
1-(2-methylphenyl)-2-phenylnaphthalene
CID 101418577
(2-butylphenyl)-diphenylphosphanium bromide
CID 18702722
ethane;2-(2-methylphenyl)-1-[2-(2-methylphenyl)naphthalen-1-yl]naphthalene
CID 91083814
palladium;triphenylphosphanium
CID 22229115
palladium;tetrakis(triphenylphosphanium)
CID 54587875

Frequently Asked Questions

What is the IUPAC name of [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+)?
The IUPAC name of [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+) (CID 146164742) is [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+).
What is the SMILES notation for [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+)?
The canonical SMILES for [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+) is [NH-]c1ccc2ccccc2c1-c1c([NH-])ccc2ccccc12.[Pd+2].c1ccc([PH+](c2ccccc2)c2ccccc2-c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+)?
The InChIKey is USZLDDCKILKWSF-UHFFFAOYSA-P. The full InChI is InChI=1S/C36H28P2.C20H14N2.Pd/c1-5-17-29(18-6-1)37(30-19-7-2-8-20-30)35-27-15-13-25-33(35)34-26-14-16-28-36(34)38(31-21-9-3-10-22-31)32-23-11-4-12-24-32;21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22;/h1-28H;1-12,21-22H;/q;-2;+2/p+2.
What are the key properties of [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+)?
[1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+) has a molecular weight of 913.35 g/mol, XLogP of 13.36, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-azanidylnaphthalen-1-yl)naphthalen-2-yl]azanide;[2-(2-diphenylphosphaniumylphenyl)phenyl]-diphenylphosphanium;palladium(2+) is sourced from PubChem (CID 146164742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).