bis(cyclopenta-1,3-diene);iron;iron(2+)

C10H10Fe2 — CID 160503469

IUPACbis(cyclopenta-1,3-diene);iron;iron(2+)
SMILES[Fe+2].[Fe].c1cc[cH-]c1.c1cc[cH-]c1
InChIInChI=1S/2C5H5.2Fe/c2*1-2-4-5-3-1;;/h2*1-5H;;/q2*-1;;+2
InChIKeyQSCAXGGEMZIPTH-UHFFFAOYSA-N
MW241.88 g/mol
LogP2.81
Rot. Bonds

About bis(cyclopenta-1,3-diene);iron;iron(2+)

bis(cyclopenta-1,3-diene);iron;iron(2+) (PubChem CID 160503469) has the molecular formula C10H10Fe2 and a molecular weight of 241.88 g/mol. Its IUPAC name is bis(cyclopenta-1,3-diene);iron;iron(2+).

Molecular Properties

Compound Namebis(cyclopenta-1,3-diene);iron;iron(2+)
PubChem CID160503469
Molecular FormulaC10H10Fe2
Molecular Weight241.88 g/mol
Exact Mass241.95
IUPAC Namebis(cyclopenta-1,3-diene);iron;iron(2+)
SMILES[Fe+2].[Fe].c1cc[cH-]c1.c1cc[cH-]c1
InChIInChI=1S/2C5H5.2Fe/c2*1-2-4-5-3-1;;/h2*1-5H;;/q2*-1;;+2
InChIKeyQSCAXGGEMZIPTH-UHFFFAOYSA-N
XLogP2.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.88
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

bis(cyclopenta-1,3-diene);iron(2+);palladium(2+)
CID 175701268
bis(cyclopenta-1,3-diene);nickel
CID 25199994
bis(cyclopenta-1,3-diene);uranium(2+)
CID 154419061
cobalt;cyclopenta-1,3-diene
CID 25199992
bis(cyclopenta-1,3-diene);gold
CID 140990202
cyclopenta-1,3-diene;cyclopentane;iron;hydrofluoride
CID 175426110
bis(cyclopenta-1,3-diene);zirconium;zirconium(2+)
CID 159549094
dilithium;cycloocta-1,3,6-triene
CID 15972602
carbanide;bis(cyclopenta-1,3-diene);zirconium(4+)
CID 72747194
cyclopenta-1,3-diene;neodymium(3+);dichloride
CID 137481493
carbanide;tris(cyclopenta-1,3-diene);tris(yttrium)
CID 175586700
hexakis(cyclopenta-1,3-diene);lanthanum(3+);rhenium
CID 45489530

Frequently Asked Questions

What is the IUPAC name of bis(cyclopenta-1,3-diene);iron;iron(2+)?
The IUPAC name of bis(cyclopenta-1,3-diene);iron;iron(2+) (CID 160503469) is bis(cyclopenta-1,3-diene);iron;iron(2+).
What is the SMILES notation for bis(cyclopenta-1,3-diene);iron;iron(2+)?
The canonical SMILES for bis(cyclopenta-1,3-diene);iron;iron(2+) is [Fe+2].[Fe].c1cc[cH-]c1.c1cc[cH-]c1.
What is the InChIKey of bis(cyclopenta-1,3-diene);iron;iron(2+)?
The InChIKey is QSCAXGGEMZIPTH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H5.2Fe/c2*1-2-4-5-3-1;;/h2*1-5H;;/q2*-1;;+2.
What are the key properties of bis(cyclopenta-1,3-diene);iron;iron(2+)?
bis(cyclopenta-1,3-diene);iron;iron(2+) has a molecular weight of 241.88 g/mol, XLogP of 2.81, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(cyclopenta-1,3-diene);iron;iron(2+) is sourced from PubChem (CID 160503469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).