Geometry & MOs

Info

ID:	61086
PubChem CID:	26705451
Reduced:	OS2N4H14C19 (1)
Stoich.:	AB2C4D14E19 (1)
Weight, g/mol:	411.055674
ΔH_f, kcal/mol:	90.25
Dipole, Da:	3.47
IP(EA), eV:	-9.0(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=NC(=C(S1)C(=O)NC2=NC(=CS2)C3=CC=CC=N3)C4=CC=CC=C4

DOS

IR

Vibrations