bis(chloranyl)iron; 1-[5-[(E)-N-isocyano-C-methyl-carbonimidoyl]thiophen-2-yl]ethylidenecyanamide

Systemtic Name: bis(chloranyl)iron; 1-[5-[(E)-N-isocyano-C-methyl-carbonimidoyl]thiophen-2-yl]ethylidenecyanamide Openeye Name: dichloroiron; 1-[5-[(E)-N-isocyano-C-methyl-carbonimidoyl]-2-thienyl]ethylidenecyanamide CAS Name: dichloroiron; 1-[5-[(1E)-1-isocyanoiminoethyl]-2-thiophenyl]ethylidenecyanamide IUPAC Name: dichloroiron; 1-[5-[(E)-N-isocyano-C-methylcarbonimidoyl]thiophen-2-yl]ethylidenecyanamide Traditional Name: dichloroiron; 1-[5-[(E)-N-isocyano-C-methyl-carbonimidoyl]-2-thienyl]ethylidenecyanamide Formula: C10H8Cl2FeN4S MolecularWeight: 343.01332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC#N)C1=CC=C(S1)C(=N[N+]#[C-])C.Cl[Fe]Cl

Isomeric SMILES

CC(=NC#N)C1=CC=C(S1)/C(=N/[N+]#[C-])/C.Cl[Fe]Cl

InChI

InChI=1S/C10H8N4S.2ClH.Fe/c1-7(13-6-11)9-4-5-10(15-9)8(2)14-12-3;;;/h4-5H,1-2H3;2*1H;/q;;;+2/p-2/b13-7?,14-8+;;;