Geometry & MOs

Info

ID:	445887
PubChem CID:	135269873
Reduced:	O2F3N3C21H24 (1)
Stoich.:	A2B3C3D21E24 (1)
Weight, g/mol:	332.138559
ΔH_f, kcal/mol:	-145.54
Dipole, Da:	4.55
IP(EA), eV:	-9.02(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-1-(methylideneamino)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)-2-(1-pyridin-3-ylethylideneamino)ethenamine

Drug info:

PubChemData

Smile

CC1CN(CC(N1CC2=CC=C(C=C2)C(=O)NO)C)CC3=CC(=C(C=C3F)F)F

DOS

IR

Vibrations