Geometry & MOs

Info

ID:	262469
PubChem CID:	103294730
Reduced:	FSO2N3C12H14 (1)
Stoich.:	ABC2D3E12F14 (1)
Weight, g/mol:	276.175025
ΔH_f, kcal/mol:	-87.81
Dipole, Da:	5.08
IP(EA), eV:	-9.0(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]-1H-benzimidazol-2-amine

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CCC1NC2=NC3=C(N2)C=C(C=C3)F

DOS

IR

Vibrations