Geometry & MOs

Info

ID:	441848
PubChem CID:	135245884
Reduced:	ON2C15H20 (1)
Stoich.:	AB2C15D20 (1)
Weight, g/mol:	406.135365
ΔH_f, kcal/mol:	8.15
Dipole, Da:	3.3
IP(EA), eV:	-9.03(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-(N-amino-2-fluoroanilino)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridin-4-ylethenamine

Drug info:

PubChemData

Smile

C1CNCCC1CCC2=CN=C3C2=CC(C=C3)O

DOS

IR

Vibrations