Chemical Properties of 1,1'-Bis[n-methyl-n-(4-nitrophenyl)-carboxamido] ferrocene

InChI

InChI=1S/2C13H11N2O3.Fe/c2*1-14(13(16)10-4-2-3-5-10)11-6-8-12(9-7-11)15(17)18;/h2*2-9H,1H3;

InChI Key

HLMPYPKBWSNNEU-UHFFFAOYSA-N

Formula

C26H22FeN4O6

SMILES

CN(C(=O)C1=CC=C[CH]1[Fe][CH]1C=CC=C1C(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1

Molecular Weight¹

542.32

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to 1,1'-Bis[n-methyl-n-(4-nitrophenyl)-carboxamido] ferrocene.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• NIST Webbook

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