Geometry & MOs

Info

ID:	251454
PubChem CID:	103104051
Reduced:	FN2O2C15H19 (1)
Stoich.:	AB2C2D15E19 (1)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-87.65
Dipole, Da:	4.35
IP(EA), eV:	-8.97(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[4-[2-[(2-amino-2-oxoethyl)-ethylamino]ethoxy]phenyl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CCN(CC1=C(C=C(C=C1)F)C#CCCO)CC(=O)N

DOS

IR

Vibrations