Geometry & MOs

Info

ID:	242282
PubChem CID:	96099814
Reduced:	F2N4C13H16 (1)
Stoich.:	A2B4C13D16 (1)
Weight, g/mol:	266.134303
ΔH_f, kcal/mol:	-41.2
Dipole, Da:	3.53
IP(EA), eV:	-9.11(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6,7-difluoro-1-[(3S)-pyrrolidin-3-yl]benzimidazol-2-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CNCC1=NC2=C(N1[C@@H]3CCNC3)C(=C(C=C2)F)F

DOS

IR

Vibrations