Geometry & MOs

Info

ID:	245463
PubChem CID:	99445075
Reduced:	FSN3O4H22C24 (1)
Stoich.:	ABC3D4E22F24 (1)
Weight, g/mol:	376.122321
ΔH_f, kcal/mol:	-91.43
Dipole, Da:	9.17
IP(EA), eV:	-9.4(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-fluorophenyl)-N-(furan-2-ylmethyl)-2-(1-methylidene-3-oxoisoindol-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)N(CC2=CC=CO2)C3=CC=CC=C3F)S(=O)(=O)C4=CC=CC=C4C#N

DOS

IR

Vibrations