Geometry & MOs

Info

ID:	419755
PubChem CID:	135108971
Reduced:	FSO3N4C18H23 (1)
Stoich.:	ABC3D4E18F23 (1)
Weight, g/mol:	309.125946
ΔH_f, kcal/mol:	-121.99
Dipole, Da:	6.35
IP(EA), eV:	-8.68(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-5-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]amino]methyl]-1,2,4-oxadiazole-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC(=NC(=N1)N2CCOCC2)NCCS(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations