Geometry & MOs

Info

ID:	145793
PubChem CID:	53593527
Reduced:	NSO6C15H23 (1)
Stoich.:	ABC6D15E23 (1)
Weight, g/mol:	348.094392
ΔH_f, kcal/mol:	-243.26
Dipole, Da:	6.23
IP(EA), eV:	-8.86(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-4-fluoro-2-[(3-methylsulfonylphenoxy)methyl]benzimidazole

Drug info:

PubChemData

Smile

CCC(C(=O)NS(=O)(=O)C1=CC(=C(C=C1)OCC)OCC)OC

DOS

IR

Vibrations