Geometry & MOs

Info

ID:	259349
PubChem CID:	103164453
Reduced:	SO2N3C12H21 (1)
Stoich.:	AB2C3D12E21 (1)
Weight, g/mol:	244.121178
ΔH_f, kcal/mol:	-51.96
Dipole, Da:	6.62
IP(EA), eV:	-8.45(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclobutylmethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazole

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC2=NNC(=S)N2CCOC

DOS

IR

Vibrations