Geometry & MOs

Info

ID:	121090
PubChem CID:	50755492
Reduced:	ClFN3O3H17C20 (1)
Stoich.:	ABC3D3E17F20 (1)
Weight, g/mol:	404.130697
ΔH_f, kcal/mol:	-131.52
Dipole, Da:	7.67
IP(EA), eV:	-8.88(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-ethyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-1,3-thiazol-2-yl]-3,4-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)NC(=O)CN2C(=O)C=CN(C2=O)CC3=CC(=CC=C3)F

DOS

IR

Vibrations