carbon monoxide; 1,3-ditert-butylcyclopentane; iron

Systemtic Name: carbon monoxide; 1,3-ditert-butylcyclopentane; iron Openeye Name: carbon monoxide; 1,3-ditert-butylcyclopentane; iron CAS Name: carbon monoxide; 1,3-ditert-butylcyclopentane; iron IUPAC Name: carbon monoxide; 1,3-ditert-butylcyclopentane; iron Traditional Name: carbon monoxide; 1,3-ditert-butylcyclopentane; iron Formula: C30H42Fe2O4 MolecularWeight: 578.34208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[C]1[CH][CH][C]([CH]1)C(C)(C)C.CC(C)(C)[C]1[CH][CH][C]([CH]1)C(C)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe]

Isomeric SMILES

CC(C)(C)[C]1[CH][CH][C]([CH]1)C(C)(C)C.CC(C)(C)[C]1[CH][CH][C]([CH]1)C(C)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe]

InChI

InChI=1S/2C13H21.4CO.2Fe/c2*1-12(2,3)10-7-8-11(9-10)13(4,5)6;4*1-2;;/h2*7-9H,1-6H3;;;;;;