Geometry & MOs

Info

ID:	277601
PubChem CID:	103829779
Reduced:	FSN2O2C13H13 (1)
Stoich.:	ABC2D2E13F13 (1)
Weight, g/mol:	299.018306
ΔH_f, kcal/mol:	-88.82
Dipole, Da:	3.32
IP(EA), eV:	-9.04(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-chlorothiophen-2-yl)ethyl]-4-fluoro-2-hydroxybenzamide

Drug info:

PubChemData

Smile

CCC1=C(SC(=N1)NC(=O)C2=C(C=C(C=C2)F)O)C

DOS

IR

Vibrations