Geometry & MOs

Info

ID:	386970
PubChem CID:	134983542
Reduced:	O2C15H22 (2)
Stoich.:	A2B15C22 (2)
Weight, g/mol:	250.02923
ΔH_f, kcal/mol:	-201.74
Dipole, Da:	5.03
IP(EA), eV:	-9.37(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

carbon monoxide;iron;(2E,4E)-6-methylhepta-2,4-diene

Drug info:

PubChemData

Smile

C[C@]1(CCCC1(C)C)C2=C[C@@H]3[C@H]4[C@@H]([C@H]2C(=O)[C@]3(C)O)C(=CC(=O)[C@@]4(C)O)[C@@]5(CCCC5(C)C)C

DOS

IR

Vibrations