Geometry & MOs

Info

ID:	242291
PubChem CID:	96099823
Reduced:	O2N6C17H20 (1)
Stoich.:	A2B6C17D20 (1)
Weight, g/mol:	248.143725
ΔH_f, kcal/mol:	45.61
Dipole, Da:	1.58
IP(EA), eV:	-9.36(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-fluoro-1-[(3R)-pyrrolidin-3-yl]benzimidazol-2-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)[C@H]2CCCN2C(=O)CN3C4=CC=CC=C4N=N3

DOS

IR

Vibrations