Geometry & MOs

Info

ID:	66082
PubChem CID:	46491041
Reduced:	FN3O3C25H28 (1)
Stoich.:	AB3C3D25E28 (1)
Weight, g/mol:	274.073576
ΔH_f, kcal/mol:	-130.77
Dipole, Da:	3.11
IP(EA), eV:	-8.94(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]acetyl]amino]carbamate

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)CC(=O)NC(CC(=O)OC(C)C)C3=CC=CC=C3

DOS

IR

Vibrations