bis(acetonitrile);palladium;hydrochloride

C4H7ClN2Pd — CID 173031121

IUPACbis(acetonitrile);palladium;hydrochloride
SMILESCC#N.CC#N.Cl.[Pd]
InChIInChI=1S/2C2H3N.ClH.Pd/c2*1-2-3;;/h2*1H3;1H;
InChIKeyZUWKPANNASNMHU-UHFFFAOYSA-N
MW224.99 g/mol
LogP1.48
Rot. Bonds

About bis(acetonitrile);palladium;hydrochloride

bis(acetonitrile);palladium;hydrochloride (PubChem CID 173031121) has the molecular formula C4H7ClN2Pd and a molecular weight of 224.99 g/mol. Its IUPAC name is bis(acetonitrile);palladium;hydrochloride.

Molecular Properties

Compound Namebis(acetonitrile);palladium;hydrochloride
PubChem CID173031121
Molecular FormulaC4H7ClN2Pd
Molecular Weight224.99 g/mol
Exact Mass223.93
IUPAC Namebis(acetonitrile);palladium;hydrochloride
SMILESCC#N.CC#N.Cl.[Pd]
InChIInChI=1S/2C2H3N.ClH.Pd/c2*1-2-3;;/h2*1H3;1H;
InChIKeyZUWKPANNASNMHU-UHFFFAOYSA-N
XLogP1.48
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.99
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of bis(acetonitrile);palladium;hydrochloride?
The IUPAC name of bis(acetonitrile);palladium;hydrochloride (CID 173031121) is bis(acetonitrile);palladium;hydrochloride.
What is the SMILES notation for bis(acetonitrile);palladium;hydrochloride?
The canonical SMILES for bis(acetonitrile);palladium;hydrochloride is CC#N.CC#N.Cl.[Pd].
What is the InChIKey of bis(acetonitrile);palladium;hydrochloride?
The InChIKey is ZUWKPANNASNMHU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H3N.ClH.Pd/c2*1-2-3;;/h2*1H3;1H;.
What are the key properties of bis(acetonitrile);palladium;hydrochloride?
bis(acetonitrile);palladium;hydrochloride has a molecular weight of 224.99 g/mol, XLogP of 1.48, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(acetonitrile);palladium;hydrochloride is sourced from PubChem (CID 173031121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).