Geometry & MOs

Info

ID:	68353
PubChem CID:	46508240
Reduced:	ClSN3O4C15H18 (1)
Stoich.:	ABC3D4E15F18 (1)
Weight, g/mol:	447.124192
ΔH_f, kcal/mol:	-127.86
Dipole, Da:	7.94
IP(EA), eV:	-9.26(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCC(CC1)C(=O)OCC2=CN3C=C(C=CC3=N2)Cl

DOS

IR

Vibrations