Geometry & MOs

Info

ID:	389776
PubChem CID:	134995169
Reduced:	O2C11H14 (1)
Stoich.:	A2B11C14 (1)
Weight, g/mol:	294.019059
ΔH_f, kcal/mol:	-79.12
Dipole, Da:	1.36
IP(EA), eV:	-9.57(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

carbon monoxide;ethyl (2R,3E)-2-methylhexa-3,5-dienoate;iron

Drug info:

PubChemData

Smile

C[C@H]1[C@@H](C[C@@H](O1)C2=CC=CC=C2)O

DOS

IR

Vibrations