Geometry & MOs

Info

ID:	26776
PubChem CID:	798291
Reduced:	OSN3H15C16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	301.111422
ΔH_f, kcal/mol:	64.17
Dipole, Da:	1.96
IP(EA), eV:	-7.99(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[[2-(4-fluorophenyl)acetyl]amino]benzoate

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2SC1=NN=CC3=CC=CC=C3OC

DOS

IR

Vibrations