Geometry & MOs

Info

ID:	39275
PubChem CID:	8140034
Reduced:	SN2O3C19H24 (1)
Stoich.:	AB2C3D19E24 (1)
Weight, g/mol:	370.132885
ΔH_f, kcal/mol:	-80.79
Dipole, Da:	5.84
IP(EA), eV:	-9.0(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S)-1-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-(3,5-dimethylphenoxy)acetate

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1CNC(=O)CCS(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations