Geometry & MOs

Info

ID:	222540
PubChem CID:	85305484
Reduced:	N2F3O3H17C18 (1)
Stoich.:	A2B3C3D17E18 (1)
Weight, g/mol:	366.142701
ΔH_f, kcal/mol:	-139.67
Dipole, Da:	4.73
IP(EA), eV:	-8.98(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3-acetamido-4-acetyloxyphenyl)-2-(methoxycarbonylamino)propyl] acetate

Drug info:

PubChemData

Smile

CCONC(=C(C)N=O)C1=CC=C(C=C1)OC2=CC=CC(=C2)C(F)(F)F

DOS

IR

Vibrations