Geometry & MOs

Info

ID:	29101
PubChem CID:	831646
Reduced:	OS2N3C10H11 (1)
Stoich.:	AB2C3D10E11 (1)
Weight, g/mol:	247.064471
ΔH_f, kcal/mol:	22.56
Dipole, Da:	4.66
IP(EA), eV:	-8.81(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-fluorophenyl)-2-oxoethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN=C(S1)NC(=O)CC2=CC=CS2

DOS

IR

Vibrations