azane;trichloroiron

H3Cl3FeN — CID 160670195

IUPACazane;trichloroiron
SMILESCl[Fe](Cl)Cl.N
InChIInChI=1S/3ClH.Fe.H3N/h3*1H;;1H3/q;;;+3;/p-3
InChIKeyRMVGMEUIEICADN-UHFFFAOYSA-K
MW179.24 g/mol
LogP2.23
Rot. Bonds

About azane;trichloroiron

azane;trichloroiron (PubChem CID 160670195) has the molecular formula H3Cl3FeN and a molecular weight of 179.24 g/mol. Its IUPAC name is azane;trichloroiron.

Molecular Properties

Compound Nameazane;trichloroiron
PubChem CID160670195
Molecular FormulaH3Cl3FeN
Molecular Weight179.24 g/mol
Exact Mass177.87
IUPAC Nameazane;trichloroiron
SMILESCl[Fe](Cl)Cl.N
InChIInChI=1S/3ClH.Fe.H3N/h3*1H;;1H3/q;;;+3;/p-3
InChIKeyRMVGMEUIEICADN-UHFFFAOYSA-K
XLogP2.23
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of azane;trichloroiron?
The IUPAC name of azane;trichloroiron (CID 160670195) is azane;trichloroiron.
What is the SMILES notation for azane;trichloroiron?
The canonical SMILES for azane;trichloroiron is Cl[Fe](Cl)Cl.N.
What is the InChIKey of azane;trichloroiron?
The InChIKey is RMVGMEUIEICADN-UHFFFAOYSA-K. The full InChI is InChI=1S/3ClH.Fe.H3N/h3*1H;;1H3/q;;;+3;/p-3.
What are the key properties of azane;trichloroiron?
azane;trichloroiron has a molecular weight of 179.24 g/mol, XLogP of 2.23, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;trichloroiron is sourced from PubChem (CID 160670195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).