Rhenium,pentacarbonyl(triphenylstannyl)-

C23H15O5ReSn — CID 6327306

IUPAC—
SMILES[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Re].c1ccc([Sn](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/3C6H5.5CO.Re.Sn/c3*1-2-4-6-5-3-1;5*1-2;;/h3*1-5H;;;;;;;
InChIKeyLJLHURSBUJECJZ-UHFFFAOYSA-N
MW676.29 g/mol
LogP2.01
Rot. Bonds3

About Rhenium,pentacarbonyl(triphenylstannyl)-

Rhenium,pentacarbonyl(triphenylstannyl)- (PubChem CID 6327306) has the molecular formula C23H15O5ReSn and a molecular weight of 676.29 g/mol.

Molecular Properties

Compound NameRhenium,pentacarbonyl(triphenylstannyl)-
PubChem CID6327306
Molecular FormulaC23H15O5ReSn
Molecular Weight676.29 g/mol
Exact Mass677.95
IUPAC Name—
SMILES[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Re].c1ccc([Sn](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/3C6H5.5CO.Re.Sn/c3*1-2-4-6-5-3-1;5*1-2;;/h3*1-5H;;;;;;;
InChIKeyLJLHURSBUJECJZ-UHFFFAOYSA-N
XLogP2.01
TPSA99.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500676.29
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of Rhenium,pentacarbonyl(triphenylstannyl)-?
The IUPAC name of Rhenium,pentacarbonyl(triphenylstannyl)- (CID 6327306) is not available.
What is the SMILES notation for Rhenium,pentacarbonyl(triphenylstannyl)-?
The canonical SMILES for Rhenium,pentacarbonyl(triphenylstannyl)- is [C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Re].c1ccc([Sn](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of Rhenium,pentacarbonyl(triphenylstannyl)-?
The InChIKey is LJLHURSBUJECJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H5.5CO.Re.Sn/c3*1-2-4-6-5-3-1;5*1-2;;/h3*1-5H;;;;;;;.
What are the key properties of Rhenium,pentacarbonyl(triphenylstannyl)-?
Rhenium,pentacarbonyl(triphenylstannyl)- has a molecular weight of 676.29 g/mol, XLogP of 2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Rhenium,pentacarbonyl(triphenylstannyl)- is sourced from PubChem (CID 6327306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).