Geometry & MOs

Info

ID:	267971
PubChem CID:	103592240
Reduced:	FOSN3C12H14 (1)
Stoich.:	ABCD3E12F14 (1)
Weight, g/mol:	300.109648
ΔH_f, kcal/mol:	-67.15
Dipole, Da:	2.09
IP(EA), eV:	-8.53(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-ethylphenyl)methyl]-6-fluoro-5-methyl-1H-benzimidazole-2-thione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1F)NC(=S)N2C(C)(C)C(=O)N

DOS

IR

Vibrations