nonamagnesium;hydride;iron;nickel

H18Fe4Mg9Ni4 — CID 173395073

IUPACnonamagnesium;hydride;iron;nickel
SMILES[Fe].[Fe].[Fe].[Fe].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Ni].[Ni].[Ni].[Ni]
InChIInChI=1S/4Fe.9Mg.4Ni.18H/q;;;;9*+2;;;;;18*-1
InChIKeyPRPHXRKMPCZZPK-UHFFFAOYSA-N
MW695.04 g/mol
LogP-1.42
Rot. Bonds

About nonamagnesium;hydride;iron;nickel

nonamagnesium;hydride;iron;nickel (PubChem CID 173395073) has the molecular formula H18Fe4Mg9Ni4 and a molecular weight of 695.04 g/mol. Its IUPAC name is nonamagnesium;hydride;iron;nickel.

Molecular Properties

Compound Namenonamagnesium;hydride;iron;nickel
PubChem CID173395073
Molecular FormulaH18Fe4Mg9Ni4
Molecular Weight695.04 g/mol
Exact Mass689.49
IUPAC Namenonamagnesium;hydride;iron;nickel
SMILES[Fe].[Fe].[Fe].[Fe].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Ni].[Ni].[Ni].[Ni]
InChIInChI=1S/4Fe.9Mg.4Ni.18H/q;;;;9*+2;;;;;18*-1
InChIKeyPRPHXRKMPCZZPK-UHFFFAOYSA-N
XLogP-1.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500695.04
LogP ≤ 5-1.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 nonamagnesium;hydride;iron;nickel?
The IUPAC name of nonamagnesium;hydride;iron;nickel (CID 173395073) is nonamagnesium;hydride;iron;nickel.
What is the SMILES notation for nonamagnesium;hydride;iron;nickel?
The canonical SMILES for nonamagnesium;hydride;iron;nickel is [Fe].[Fe].[Fe].[Fe].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Ni].[Ni].[Ni].[Ni].
What is the InChIKey of nonamagnesium;hydride;iron;nickel?
The InChIKey is PRPHXRKMPCZZPK-UHFFFAOYSA-N. The full InChI is InChI=1S/4Fe.9Mg.4Ni.18H/q;;;;9*+2;;;;;18*-1.
What are the key properties of nonamagnesium;hydride;iron;nickel?
nonamagnesium;hydride;iron;nickel has a molecular weight of 695.04 g/mol, XLogP of -1.42, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for nonamagnesium;hydride;iron;nickel is sourced from PubChem (CID 173395073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).