Geometry & MOs

Info

ID:	149570
PubChem CID:	53789243
Reduced:	FO2H19C25 (1)
Stoich.:	AB2C19D25 (1)
Weight, g/mol:	296.116092
ΔH_f, kcal/mol:	-17.18
Dipole, Da:	2.68
IP(EA), eV:	-8.86(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-(N-methylanilino)-1,3-benzoxazol-6-yl]acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=CC=C2C3=C(C(=CC=C3)OC4=CC=CC=C4)F

DOS

IR

Vibrations