Geometry & MOs

Info

ID:	21889
PubChem CID:	593070
Reduced:	NO2H13C14 (1)
Stoich.:	AB2C13D14 (1)
Weight, g/mol:	227.094629
ΔH_f, kcal/mol:	-12.58
Dipole, Da:	2.91
IP(EA), eV:	-9.7(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-(4-cyanophenyl)penta-2,4-dienoate

Drug info:

PubChemData

Smile

CCOC(=O)C=CC=CC1=CC=C(C=C1)C#N

DOS

IR

Vibrations