ethene;platinum;bis(triphenylphosphane)

C38H34P2Pt — CID 2734701

IUPACethene;platinum;bis(triphenylphosphane)
SMILESC=C.[Pt].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H15P.C2H4.Pt/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;/h2*1-15H;1-2H2;
InChIKeyRZUASTIKPBCXPU-UHFFFAOYSA-N
MW747.72 g/mol
LogP7.69
Rot. Bonds6

About ethene;platinum;bis(triphenylphosphane)

ethene;platinum;bis(triphenylphosphane) (PubChem CID 2734701) has the molecular formula C38H34P2Pt and a molecular weight of 747.72 g/mol. Its IUPAC name is ethene;platinum;bis(triphenylphosphane).

Molecular Properties

Compound Nameethene;platinum;bis(triphenylphosphane)
PubChem CID2734701
Molecular FormulaC38H34P2Pt
Molecular Weight747.72 g/mol
Exact Mass747.18
IUPAC Nameethene;platinum;bis(triphenylphosphane)
SMILESC=C.[Pt].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H15P.C2H4.Pt/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;/h2*1-15H;1-2H2;
InChIKeyRZUASTIKPBCXPU-UHFFFAOYSA-N
XLogP7.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500747.72
LogP ≤ 57.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethene;platinum;bis(triphenylphosphane)?
The IUPAC name of ethene;platinum;bis(triphenylphosphane) (CID 2734701) is ethene;platinum;bis(triphenylphosphane).
What is the SMILES notation for ethene;platinum;bis(triphenylphosphane)?
The canonical SMILES for ethene;platinum;bis(triphenylphosphane) is C=C.[Pt].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of ethene;platinum;bis(triphenylphosphane)?
The InChIKey is RZUASTIKPBCXPU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H15P.C2H4.Pt/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;/h2*1-15H;1-2H2;.
What are the key properties of ethene;platinum;bis(triphenylphosphane)?
ethene;platinum;bis(triphenylphosphane) has a molecular weight of 747.72 g/mol, XLogP of 7.69, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;platinum;bis(triphenylphosphane) is sourced from PubChem (CID 2734701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).