Geometry & MOs

Info

ID:	53353
PubChem CID:	14710598
Reduced:	O2C5H7 (2)
Stoich.:	A2B5C7 (2)
Weight, g/mol:	366.040189
ΔH_f, kcal/mol:	-152.74
Dipole, Da:	2.9
IP(EA), eV:	-10.18(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

carbon monoxide;(1-ethoxy-1-oxopropan-2-yl) (E)-4-methylidenehex-2-enoate;iron

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](C)OC(=O)/C=C/C=C

DOS

IR

Vibrations