Geometry & MOs

Info

ID:	386868
PubChem CID:	134983192
Reduced:	OC16H20 (1)
Stoich.:	AB16C20 (1)
Weight, g/mol:	358.00161
ΔH_f, kcal/mol:	-15.09
Dipole, Da:	4.14
IP(EA), eV:	-9.08(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2E,4E)-2-(2-bromo-2,2-difluoroacetyl)-5-phenylpenta-2,4-dienoate

Drug info:

PubChemData

Smile

CCCC/C=C\C=C\C1=CC=C(C=C1)C(=O)C

DOS

IR

Vibrations