carbanide; iron(3+); 1,3,5-trimethylcyclohexa-1,3-diene

Systemtic Name: carbanide; iron(3+); 1,3,5-trimethylcyclohexa-1,3-diene Openeye Name: ferric; carbanide; 1,3,5-trimethylcyclohexa-1,3-diene CAS Name: carbanide; iron(3+); 1,3,5-trimethylcyclohexa-1,3-diene IUPAC Name: carbanide; iron(3+); 1,3,5-trimethylcyclohexa-1,3-diene Traditional Name: ferric; carbanide; 1,3,5-trimethylcyclohexa-1,3-diene Formula: C10H16Fe+ MolecularWeight: 192.07904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH3-].C[C-]1CC(=CC(=C1)C)C.[Fe+3]

Isomeric SMILES

[CH3-].C[C-]1CC(=CC(=C1)C)C.[Fe+3]

InChI

InChI=1S/C9H13.CH3.Fe/c1-7-4-8(2)6-9(3)5-7;;/h4-5H,6H2,1-3H3;1H3;/q2*-1;+3