Geometry & MOs

Info

ID:	344233
PubChem CID:	127267409
Reduced:	NSO4C15H17 (1)
Stoich.:	ABC4D15E17 (1)
Weight, g/mol:	347.043914
ΔH_f, kcal/mol:	-140.29
Dipole, Da:	1.92
IP(EA), eV:	-8.85(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[2-oxo-2-(2,2,2-trifluoroethylamino)ethoxy]-1-benzothiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)NC(=O)COC1=C2C=C(SC2=CC=C1)C(=O)OC

DOS

IR

Vibrations