Geometry & MOs

Info

ID:	281242
PubChem CID:	103911631
Reduced:	FNC3H3 (4)
Stoich.:	ABC3D3 (4)
Weight, g/mol:	251.152144
ΔH_f, kcal/mol:	-138.95
Dipole, Da:	7.48
IP(EA), eV:	-9.19(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[(2-methoxy-1-phenylethyl)amino]propanoate

Drug info:

PubChemData

Smile

CC(C1=NN=CN1C)NC2=C(C=C(C=C2)C(F)(F)F)F

DOS

IR

Vibrations