Geometry & MOs

Info

ID:	142459
PubChem CID:	53037585
Reduced:	OSN3C21H21 (1)
Stoich.:	ABC3D21E21 (1)
Weight, g/mol:	378.149204
ΔH_f, kcal/mol:	39.37
Dipole, Da:	4.34
IP(EA), eV:	-8.34(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-methyl-N-[2-[(5Z)-5-(5-methylindol-2-ylidene)-2H-1,2,4-oxadiazol-3-yl]ethyl]benzamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

DOS

IR

Vibrations