iron(2+);manganese(2+);tetracyanide;hydrate

C4H2FeMnN4O — CID 163215673

IUPACiron(2+);manganese(2+);tetracyanide;hydrate
SMILESO.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Mn+2]
InChIInChI=1S/4CN.Fe.Mn.H2O/c4*1-2;;;/h;;;;;;1H2/q4*-1;2*+2;
InChIKeyJNFLRFMTKYLBCO-UHFFFAOYSA-N
MW232.87 g/mol
LogP-0.44
Rot. Bonds

About iron(2+);manganese(2+);tetracyanide;hydrate

iron(2+);manganese(2+);tetracyanide;hydrate (PubChem CID 163215673) has the molecular formula C4H2FeMnN4O and a molecular weight of 232.87 g/mol. Its IUPAC name is iron(2+);manganese(2+);tetracyanide;hydrate.

Molecular Properties

Compound Nameiron(2+);manganese(2+);tetracyanide;hydrate
PubChem CID163215673
Molecular FormulaC4H2FeMnN4O
Molecular Weight232.87 g/mol
Exact Mass232.90
IUPAC Nameiron(2+);manganese(2+);tetracyanide;hydrate
SMILESO.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Mn+2]
InChIInChI=1S/4CN.Fe.Mn.H2O/c4*1-2;;;/h;;;;;;1H2/q4*-1;2*+2;
InChIKeyJNFLRFMTKYLBCO-UHFFFAOYSA-N
XLogP-0.44
TPSA126.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.87
LogP ≤ 5-0.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of iron(2+);manganese(2+);tetracyanide;hydrate?
The IUPAC name of iron(2+);manganese(2+);tetracyanide;hydrate (CID 163215673) is iron(2+);manganese(2+);tetracyanide;hydrate.
What is the SMILES notation for iron(2+);manganese(2+);tetracyanide;hydrate?
The canonical SMILES for iron(2+);manganese(2+);tetracyanide;hydrate is O.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Mn+2].
What is the InChIKey of iron(2+);manganese(2+);tetracyanide;hydrate?
The InChIKey is JNFLRFMTKYLBCO-UHFFFAOYSA-N. The full InChI is InChI=1S/4CN.Fe.Mn.H2O/c4*1-2;;;/h;;;;;;1H2/q4*-1;2*+2;.
What are the key properties of iron(2+);manganese(2+);tetracyanide;hydrate?
iron(2+);manganese(2+);tetracyanide;hydrate has a molecular weight of 232.87 g/mol, XLogP of -0.44, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for iron(2+);manganese(2+);tetracyanide;hydrate is sourced from PubChem (CID 163215673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).