Geometry & MOs

Info

ID:	288826
PubChem CID:	104326493
Reduced:	FN2O4C14H19 (1)
Stoich.:	AB2C4D14E19 (1)
Weight, g/mol:	298.132885
ΔH_f, kcal/mol:	-205.85
Dipole, Da:	2.09
IP(EA), eV:	-8.45(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-ethoxy-3-fluorophenyl)carbamoyl-propan-2-ylamino]acetic acid

Drug info:

PubChemData

Smile

CCN(CCC(=O)O)C(=O)NC1=CC(=C(C=C1)OCC)F

DOS

IR

Vibrations