Geometry & MOs

Info

ID:	34342
PubChem CID:	7890851
Reduced:	N2F3O3H13C16 (1)
Stoich.:	A2B3C3D13E16 (1)
Weight, g/mol:	392.137222
ΔH_f, kcal/mol:	-220.06
Dipole, Da:	7.84
IP(EA), eV:	-9.16(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] 1-hydroxynaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=C(C(=C(C=C1)F)F)F)OC(=O)C2=CC=C(C=C2)N

DOS

IR

Vibrations