Geometry & MOs

Info

ID:	53455
PubChem CID:	14716082
Reduced:	NO2C7H11 (1)
Stoich.:	AB2C7D11 (1)
Weight, g/mol:	217.110279
ΔH_f, kcal/mol:	-44.69
Dipole, Da:	4.1
IP(EA), eV:	-9.96(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-1-phenylpropylideneamino] (E)-but-2-enoate

Drug info:

PubChemData

Smile

C/C=C/C(=O)ON=C(C)C

DOS

IR

Vibrations