Geometry & MOs

Info

ID:	132927
PubChem CID:	51447843
Reduced:	FN4O4H15C18 (1)
Stoich.:	AB4C4D15E18 (1)
Weight, g/mol:	482.043627
ΔH_f, kcal/mol:	-41.15
Dipole, Da:	5.43
IP(EA), eV:	-8.78(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(2,3-dichloroanilino)-1-oxopropan-2-yl] 4-(1,3-dioxoisoindol-2-yl)benzoate

Drug info:

PubChemData

Smile

CC1=C(C=CO1)C(=O)N=NC(=O)[C@H]2C(=CC(=C)N(N2)C3=CC=CC=C3F)O

DOS

IR

Vibrations