carbon monoxide; (1Z,3Z,5Z)-cycloocta-1,3,5-triene; iron; triphenylphosphane

Systemtic Name: carbon monoxide; (1Z,3Z,5Z)-cycloocta-1,3,5-triene; iron; triphenylphosphane Openeye Name: carbon monoxide; (1Z,3Z,5Z)-cycloocta-1,3,5-triene; iron; triphenylphosphane CAS Name: carbon monoxide; (1Z,3Z,5Z)-cycloocta-1,3,5-triene; iron; triphenylphosphine IUPAC Name: carbon monoxide; (1Z,3Z,5Z)-cycloocta-1,3,5-triene; iron; triphenylphosphane Traditional Name: carbon monoxide; (1Z,3Z,5Z)-cycloocta-1,3,5-triene; iron; triphenylphosphine Formula: C28H25FeO2P MolecularWeight: 480.315661

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].C1CC=CC=CC=C1.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Fe]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].C1/C=C\C=C/C=C\C1.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Fe]

InChI

InChI=1S/C18H15P.C8H10.2CO.Fe/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-6-8-7-5-3-1;2*1-2;/h1-15H;1-6H,7-8H2;;;/b;2-1-,5-3-,6-4-;;;