Geometry & MOs

Info

ID:	446676
PubChem CID:	135276860
Reduced:	OSN2H8C11 (1)
Stoich.:	ABC2D8E11 (1)
Weight, g/mol:	411.22704
ΔH_f, kcal/mol:	49.22
Dipole, Da:	1.85
IP(EA), eV:	-8.59(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[(E)-1-[(methylideneamino)methylideneamino]prop-1-en-2-yl]-1,2,4-oxadiazol-5-yl]methyl]-N-propan-2-yl-2-(4-propylphenoxy)acetamide

Drug info:

PubChemData

Smile

C1=CNC(=C1)C2=CC=C(S2)C3=CN=CO3

DOS

IR

Vibrations