Geometry & MOs

Info

ID:	89104
PubChem CID:	49959394
Reduced:	SCl2N2O2H12C16 (1)
Stoich.:	AB2C2D2E12F16 (1)
Weight, g/mol:	364.038148
ΔH_f, kcal/mol:	22.2
Dipole, Da:	4.81
IP(EA), eV:	-9.13(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(2,4-dichlorophenoxy)propyl]-5-[(E)-2-(furan-2-yl)ethenyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C1=NN=C(O1)/C=C/C2=CC=CS2)OC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations