Geometry & MOs

Info

ID:	154959
PubChem CID:	56314516
Reduced:	FO2S2N3H18C19 (1)
Stoich.:	AB2C2D3E18F19 (1)
Weight, g/mol:	480.126755
ΔH_f, kcal/mol:	-46.96
Dipole, Da:	9.95
IP(EA), eV:	-8.39(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-fluoro-2-(1-methylimidazol-2-yl)sulfanylphenyl]-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide

Drug info:

PubChemData

Smile

CN1C=CN=C1SC2=C(C=C(C=C2)F)NC(=O)CSC3=CC=C(C=C3)OC

DOS

IR

Vibrations