Geometry & MOs

Info

ID:	328941
PubChem CID:	126729409
Reduced:	OSN3H11C14 (1)
Stoich.:	ABC3D11E14 (1)
Weight, g/mol:	549.11252
ΔH_f, kcal/mol:	74.79
Dipole, Da:	3.17
IP(EA), eV:	-8.53(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[[3-[(2-chlorophenyl)methoxy]phenyl]methoxy]-6-methoxy-1-benzofuran-2-yl]-2-methoxy-2,3-dihydroimidazo[2,1-b][1,3,4]thiadiazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=C2)C3=CN4C(=N3)SC(=N4)C

DOS

IR

Vibrations