dichloropalladium;diiodocopper;bis(triphenylphosphane)

C36H30Cl2CuI2P2Pd — CID 173103937

IUPACdichloropalladium;diiodocopper;bis(triphenylphosphane)
SMILESCl[Pd]Cl.I[Cu]I.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H15P.2ClH.Cu.2HI.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;;;;/h2*1-15H;2*1H;;2*1H;/q;;;;+2;;;+2/p-4
InChIKeySRHKLCXEWJLKDU-UHFFFAOYSA-J
MW1019.26 g/mol
LogP10.03
Rot. Bonds6

About dichloropalladium;diiodocopper;bis(triphenylphosphane)

dichloropalladium;diiodocopper;bis(triphenylphosphane) (PubChem CID 173103937) has the molecular formula C36H30Cl2CuI2P2Pd and a molecular weight of 1019.26 g/mol. Its IUPAC name is dichloropalladium;diiodocopper;bis(triphenylphosphane).

Molecular Properties

Compound Namedichloropalladium;diiodocopper;bis(triphenylphosphane)
PubChem CID173103937
Molecular FormulaC36H30Cl2CuI2P2Pd
Molecular Weight1019.26 g/mol
Exact Mass1016.76
IUPAC Namedichloropalladium;diiodocopper;bis(triphenylphosphane)
SMILESCl[Pd]Cl.I[Cu]I.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H15P.2ClH.Cu.2HI.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;;;;/h2*1-15H;2*1H;;2*1H;/q;;;;+2;;;+2/p-4
InChIKeySRHKLCXEWJLKDU-UHFFFAOYSA-J
XLogP10.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001019.26
LogP ≤ 510.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

dichloropalladium;ethene;bis(triphenylphosphane)
CID 44891218
diiodopalladium;palladium;bis(triphenylphosphane)
CID 173446441
triphenylphosphane
CID 139056248
chlorogold;triphenylphosphane
CID 10874691
iodocopper;triphenylphosphane
CID 12549340
chlorosilver;triphenylphosphane
CID 12824775
plutonium;triphenylphosphane
CID 161300359
silane;triphenylphosphane
CID 161037280
tetrakis(triphenylphosphane);dihydrochloride
CID 172855409
triphenylphosphane;yttrium
CID 139917776
tris(triphenylphosphane);trihydrochloride
CID 173282987
palladium;bis(triphenylphosphane)
CID 10122028

Frequently Asked Questions

What is the IUPAC name of dichloropalladium;diiodocopper;bis(triphenylphosphane)?
The IUPAC name of dichloropalladium;diiodocopper;bis(triphenylphosphane) (CID 173103937) is dichloropalladium;diiodocopper;bis(triphenylphosphane).
What is the SMILES notation for dichloropalladium;diiodocopper;bis(triphenylphosphane)?
The canonical SMILES for dichloropalladium;diiodocopper;bis(triphenylphosphane) is Cl[Pd]Cl.I[Cu]I.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of dichloropalladium;diiodocopper;bis(triphenylphosphane)?
The InChIKey is SRHKLCXEWJLKDU-UHFFFAOYSA-J. The full InChI is InChI=1S/2C18H15P.2ClH.Cu.2HI.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;;;;/h2*1-15H;2*1H;;2*1H;/q;;;;+2;;;+2/p-4.
What are the key properties of dichloropalladium;diiodocopper;bis(triphenylphosphane)?
dichloropalladium;diiodocopper;bis(triphenylphosphane) has a molecular weight of 1019.26 g/mol, XLogP of 10.03, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloropalladium;diiodocopper;bis(triphenylphosphane) is sourced from PubChem (CID 173103937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).