Geometry & MOs

Info

ID:	260972
PubChem CID:	103211818
Reduced:	ClIO2N3C13H15 (1)
Stoich.:	ABC2D3E13F15 (1)
Weight, g/mol:	277.160183
ΔH_f, kcal/mol:	7.58
Dipole, Da:	3.06
IP(EA), eV:	-9.82(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[2-(2,2-difluoroethoxy)ethyl]-1,3,4-oxadiazol-2-yl]-N-propylpropan-1-amine

Drug info:

PubChemData

Smile

CC(C)OCC(C1=NOC(=N1)C2=CC(=C(C=C2)I)Cl)N

DOS

IR

Vibrations