Geometry & MOs

Info

ID:	288052
PubChem CID:	104310285
Reduced:	FN2O2C15H19 (1)
Stoich.:	AB2C2D15E19 (1)
Weight, g/mol:	284.096106
ΔH_f, kcal/mol:	-115.85
Dipole, Da:	9.31
IP(EA), eV:	-9.68(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethylphenyl)-6-fluoro-1H-benzimidazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CCCC(CCC)C1=NC2=C(N1)C=C(C(=C2)C(=O)O)F

DOS

IR

Vibrations