Geometry & MOs

Info

ID:	413481
PubChem CID:	135086430
Reduced:	O3C10H14 (1)
Stoich.:	A3B10C14 (1)
Weight, g/mol:	327.99603
ΔH_f, kcal/mol:	-78.85
Dipole, Da:	3.56
IP(EA), eV:	-9.72(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2E,4Z)-4-iodo-5-phenylpenta-2,4-dienoate

Drug info:

PubChemData

Smile

C/C=C/[C@@H]1[C@H]([C@@]2(CC(=C)O1)CO2)O

DOS

IR

Vibrations