Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)-

C10H14FeO2Si+4 — CID 11986650

IUPAC—
SMILESC[Si](C)C.[C-]#[O+].[C-]#[O+].[Fe+5].c1cc[cH-]c1
InChIInChI=1S/C5H5.C3H9Si.2CO.Fe/c1-2-4-5-3-1;1-4(2)3;2*1-2;/h1-5H;1-3H3;;;/q-1;;;;+5
InChIKeyITXLEQCIIYYHMD-UHFFFAOYSA-N
MW250.15 g/mol
LogP2.70
Rot. Bonds

About Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)-

Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)- (PubChem CID 11986650) has the molecular formula C10H14FeO2Si+4 and a molecular weight of 250.15 g/mol.

Molecular Properties

Compound NameIron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)-
PubChem CID11986650
Molecular FormulaC10H14FeO2Si+4
Molecular Weight250.15 g/mol
Exact Mass250.01
IUPAC Name—
SMILESC[Si](C)C.[C-]#[O+].[C-]#[O+].[Fe+5].c1cc[cH-]c1
InChIInChI=1S/C5H5.C3H9Si.2CO.Fe/c1-2-4-5-3-1;1-4(2)3;2*1-2;/h1-5H;1-3H3;;;/q-1;;;;+5
InChIKeyITXLEQCIIYYHMD-UHFFFAOYSA-N
XLogP2.70
TPSA39.80 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.15
LogP ≤ 52.70
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'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)- with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)-?
The IUPAC name of Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)- (CID 11986650) is not available.
What is the SMILES notation for Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)-?
The canonical SMILES for Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)- is C[Si](C)C.[C-]#[O+].[C-]#[O+].[Fe+5].c1cc[cH-]c1.
What is the InChIKey of Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)-?
The InChIKey is ITXLEQCIIYYHMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5.C3H9Si.2CO.Fe/c1-2-4-5-3-1;1-4(2)3;2*1-2;/h1-5H;1-3H3;;;/q-1;;;;+5.
What are the key properties of Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)-?
Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)- has a molecular weight of 250.15 g/mol, XLogP of 2.70, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Iron, dicarbonyl-pi-cyclopentadienyl(trimethylsilyl)- is sourced from PubChem (CID 11986650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).