Geometry & MOs

Info

ID:	288792
PubChem CID:	104325954
Reduced:	ClNOF2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	269.142722
ΔH_f, kcal/mol:	-98.61
Dipole, Da:	4.24
IP(EA), eV:	-8.53(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-(4-ethoxy-3-fluoroanilino)acetate

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)NCC2=C(C(=CC=C2)F)Cl)F

DOS

IR

Vibrations