nickel;trichloroiron

Cl3FeNi — CID 174378870

IUPACnickel;trichloroiron
SMILESCl[Fe](Cl)Cl.[Ni]
InChIInChI=1S/3ClH.Fe.Ni/h3*1H;;/q;;;+3;/p-3
InChIKeyRMRYMIGJBONARF-UHFFFAOYSA-K
MW220.90 g/mol
LogP2.06
Rot. Bonds

About nickel;trichloroiron

nickel;trichloroiron (PubChem CID 174378870) has the molecular formula Cl3FeNi and a molecular weight of 220.90 g/mol. Its IUPAC name is nickel;trichloroiron.

Molecular Properties

Compound Namenickel;trichloroiron
PubChem CID174378870
Molecular FormulaCl3FeNi
Molecular Weight220.90 g/mol
Exact Mass218.78
IUPAC Namenickel;trichloroiron
SMILESCl[Fe](Cl)Cl.[Ni]
InChIInChI=1S/3ClH.Fe.Ni/h3*1H;;/q;;;+3;/p-3
InChIKeyRMRYMIGJBONARF-UHFFFAOYSA-K
XLogP2.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.90
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

azanide;trichloroiron
CID 174969604
CID 159717981
CID 159717981
calcium;trichloroiron;dihydroxide
CID 174872796
dichlorozinc;trichloroiron
CID 174357902
chlorosilver;ruthenium
CID 175838735
nickel;ruthenium;silver
CID 174453287
pyridine;trichloroiron
CID 67420268
beryllium;hydride;molybdenum;ruthenium
CID 173281663
chloromethane;nickel
CID 163830168
hypochlorous acid;ruthenium
CID 173006590
nickel
CID 171736121
azanide;chlorosilver
CID 154104962

Frequently Asked Questions

What is the IUPAC name of nickel;trichloroiron?
The IUPAC name of nickel;trichloroiron (CID 174378870) is nickel;trichloroiron.
What is the SMILES notation for nickel;trichloroiron?
The canonical SMILES for nickel;trichloroiron is Cl[Fe](Cl)Cl.[Ni].
What is the InChIKey of nickel;trichloroiron?
The InChIKey is RMRYMIGJBONARF-UHFFFAOYSA-K. The full InChI is InChI=1S/3ClH.Fe.Ni/h3*1H;;/q;;;+3;/p-3.
What are the key properties of nickel;trichloroiron?
nickel;trichloroiron has a molecular weight of 220.90 g/mol, XLogP of 2.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for nickel;trichloroiron is sourced from PubChem (CID 174378870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).