Geometry & MOs

Info

ID:	263474
PubChem CID:	103370463
Reduced:	N2F3O3C12H15 (1)
Stoich.:	A2B3C3D12E15 (1)
Weight, g/mol:	343.97835
ΔH_f, kcal/mol:	-221.02
Dipole, Da:	5.03
IP(EA), eV:	-8.96(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-bromo-5-fluorophenoxy)methyl]-3,3,3-trifluoro-N'-hydroxypropanimidamide

Drug info:

PubChemData

Smile

COCC1=CC(=CC=C1)OCC(/C(=N/O)/N)C(F)(F)F

DOS

IR

Vibrations