Geometry & MOs

Info

ID:	298534
PubChem CID:	117650630
Reduced:	FNO6C17H18 (1)
Stoich.:	ABC6D17E18 (1)
Weight, g/mol:	281.126323
ΔH_f, kcal/mol:	-257.01
Dipole, Da:	1.53
IP(EA), eV:	-8.68(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxy-N-(2-oxo-2-propoxyethyl)anilino)acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C(=C(N1C2=CC=C(C=C2)CF)C(=O)OCC)O)O

DOS

IR

Vibrations