Geometry & MOs

Info

ID:	440246
PubChem CID:	135230177
Reduced:	SF3C7H11 (1)
Stoich.:	AB3C7D11 (1)
Weight, g/mol:	333.104817
ΔH_f, kcal/mol:	-162.76
Dipole, Da:	2.68
IP(EA), eV:	-9.04(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylpyrazin-2-yl)-2-(pyridin-2-ylmethylsulfanyl)benzimidazole

Drug info:

PubChemData

Smile

C=CCCSCCC(F)(F)F

DOS

IR

Vibrations