bis(sulfanylidene)iron;ethylazanide;iron

C2H6Fe2NS2- — CID 175062135

IUPACbis(sulfanylidene)iron;ethylazanide;iron
SMILESCC[NH-].S=[Fe]=S.[Fe]
InChIInChI=1S/C2H6N.2Fe.2S/c1-2-3;;;;/h3H,2H2,1H3;;;;/q-1;;;;
InChIKeyLDPVNZGICSMDLA-UHFFFAOYSA-N
MW219.90 g/mol
LogP2.35
Rot. Bonds

About bis(sulfanylidene)iron;ethylazanide;iron

bis(sulfanylidene)iron;ethylazanide;iron (PubChem CID 175062135) has the molecular formula C2H6Fe2NS2- and a molecular weight of 219.90 g/mol. Its IUPAC name is bis(sulfanylidene)iron;ethylazanide;iron.

Molecular Properties

Compound Namebis(sulfanylidene)iron;ethylazanide;iron
PubChem CID175062135
Molecular FormulaC2H6Fe2NS2-
Molecular Weight219.90 g/mol
Exact Mass219.86
IUPAC Namebis(sulfanylidene)iron;ethylazanide;iron
SMILESCC[NH-].S=[Fe]=S.[Fe]
InChIInChI=1S/C2H6N.2Fe.2S/c1-2-3;;;;/h3H,2H2,1H3;;;;/q-1;;;;
InChIKeyLDPVNZGICSMDLA-UHFFFAOYSA-N
XLogP2.35
TPSA23.80 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.90
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze bis(sulfanylidene)iron;ethylazanide;iron with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(sulfanylidene)iron;ethylazanide;iron?
The IUPAC name of bis(sulfanylidene)iron;ethylazanide;iron (CID 175062135) is bis(sulfanylidene)iron;ethylazanide;iron.
What is the SMILES notation for bis(sulfanylidene)iron;ethylazanide;iron?
The canonical SMILES for bis(sulfanylidene)iron;ethylazanide;iron is CC[NH-].S=[Fe]=S.[Fe].
What is the InChIKey of bis(sulfanylidene)iron;ethylazanide;iron?
The InChIKey is LDPVNZGICSMDLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6N.2Fe.2S/c1-2-3;;;;/h3H,2H2,1H3;;;;/q-1;;;;.
What are the key properties of bis(sulfanylidene)iron;ethylazanide;iron?
bis(sulfanylidene)iron;ethylazanide;iron has a molecular weight of 219.90 g/mol, XLogP of 2.35, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(sulfanylidene)iron;ethylazanide;iron is sourced from PubChem (CID 175062135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).