Geometry & MOs

Info

ID:	56092
PubChem CID:	17404341
Reduced:	FSN3O3H16C18 (1)
Stoich.:	ABC3D3E16F18 (1)
Weight, g/mol:	257.06522
ΔH_f, kcal/mol:	-93.66
Dipole, Da:	9.14
IP(EA), eV:	-8.89(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-3-[(2,6-difluorophenyl)methylidene]-1H-indol-2-one

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=CC(=C1)F)C2=CSC(=N2)NC(=O)CCC3=CC=CO3

DOS

IR

Vibrations