bis(chloranyl)iron; N2-(2-propan-2-ylphenyl)-N1-(pyridin-2-ylmethyl)acenaphthylene-1,2-diimine

Systemtic Name: bis(chloranyl)iron; N2-(2-propan-2-ylphenyl)-N1-(pyridin-2-ylmethyl)acenaphthylene-1,2-diimine Openeye Name: dichloroiron; N2-(2-isopropylphenyl)-N1-(2-pyridylmethyl)acenaphthylene-1,2-diimine CAS Name: dichloroiron; N2-(2-propan-2-ylphenyl)-N1-(2-pyridinylmethyl)acenaphthylene-1,2-diimine IUPAC Name: dichloroiron; 2-N-(2-propan-2-ylphenyl)-1-N-(pyridin-2-ylmethyl)acenaphthylene-1,2-diimine Traditional Name: dichloroiron; o-cumenyl-[2-(2-pyridylmethylimino)acenaphthen-1-ylidene]amine Formula: C27H23Cl2FeN3 MolecularWeight: 516.24262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N=C2C3=CC=CC4=C3C(=CC=C4)C2=NCC5=CC=CC=N5.Cl[Fe]Cl

Isomeric SMILES

CC(C)C1=CC=CC=C1N=C2C3=CC=CC4=C3C(=CC=C4)C2=NCC5=CC=CC=N5.Cl[Fe]Cl

InChI

InChI=1S/C27H23N3.2ClH.Fe/c1-18(2)21-12-3-4-15-24(21)30-27-23-14-8-10-19-9-7-13-22(25(19)23)26(27)29-17-20-11-5-6-16-28-20;;;/h3-16,18H,17H2,1-2H3;2*1H;/q;;;+2/p-2