Geometry & MOs

Info

ID:	267977
PubChem CID:	103592449
Reduced:	FSN4C15H17 (1)
Stoich.:	ABC4D15E17 (1)
Weight, g/mol:	290.100146
ΔH_f, kcal/mol:	16.11
Dipole, Da:	5.16
IP(EA), eV:	-8.32(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1,3-dimethylpyrazol-4-yl)methyl]-6-fluoro-5-methyl-1H-benzimidazole-2-thione

Drug info:

PubChemData

Smile

CCC1=NN(C=C1CN2C3=C(C=C(C(=C3)C)F)NC2=S)C

DOS

IR

Vibrations