Geometry & MOs

Info

ID:	328936
PubChem CID:	126729346
Reduced:	IN3H14C21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	303.050004
ΔH_f, kcal/mol:	155.3
Dipole, Da:	2.26
IP(EA), eV:	-9.38(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(7-methyl-1-benzofuran-2-yl)-2-methylsulfanyl-2,3-dihydroimidazo[2,1-b][1,3,4]thiadiazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC(=NC(=N3)C4=CC=CC=C4)I

DOS

IR

Vibrations