Geometry & MOs

Info

ID:	207572
PubChem CID:	80419021
Reduced:	FON3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	313.0226
ΔH_f, kcal/mol:	-62.43
Dipole, Da:	4.89
IP(EA), eV:	-8.9(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-bromo-6-fluoro-1H-benzimidazol-2-yl)methyl]morpholine

Drug info:

PubChemData

Smile

CC(C)N1C2=C(C=CC(=C2)F)N=C1CC3COCCN3

DOS

IR

Vibrations