Geometry & MOs

Info

ID:	68373
PubChem CID:	46508288
Reduced:	F3O3N4H17C18 (1)
Stoich.:	A3B3C4D17E18 (1)
Weight, g/mol:	376.062613
ΔH_f, kcal/mol:	-183.44
Dipole, Da:	8.2
IP(EA), eV:	-9.2(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-6-fluorophenyl)methyl 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate

Drug info:

PubChemData

Smile

CC1=C(C(=NC2=NC(=NN12)C(F)(F)F)C)CC(=O)OCCOC3=CC=CC=C3

DOS

IR

Vibrations