Geometry & MOs

Info

ID:	55826
PubChem CID:	17396620
Reduced:	FNO3H14C16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	319.087829
ΔH_f, kcal/mol:	-113.25
Dipole, Da:	3.79
IP(EA), eV:	-9.12(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(oxolan-2-ylmethylamino)ethyl] 1-benzothiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)F)NC(=O)C2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations