Geometry & MOs

Info

ID:	65195
PubChem CID:	29204595
Reduced:	Cl2N2O4H14C17 (1)
Stoich.:	A2B2C4D14E17 (1)
Weight, g/mol:	355.13322
ΔH_f, kcal/mol:	-101.79
Dipole, Da:	5.0
IP(EA), eV:	-9.34(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[4-(3,4-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-2-(4-fluorophenoxy)propanamide

Drug info:

PubChemData

Smile

C1COC2=C(C(=CC(=C2)C(=O)NNC(=O)C3=CC=C(C=C3)Cl)Cl)OC1

DOS

IR

Vibrations