Geometry & MOs

Info

ID:	284937
PubChem CID:	104084532
Reduced:	ClSN3C11H12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	291.966246
ΔH_f, kcal/mol:	51.32
Dipole, Da:	3.2
IP(EA), eV:	-8.71(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(chloromethyl)-2-[(5-chlorothiophen-2-yl)methylsulfanyl]-1-methylimidazole

Drug info:

PubChemData

Smile

CN1C(=CN=C1SCC2=CN=CC=C2)CCl

DOS

IR

Vibrations