Geometry & MOs

Info

ID:	167901
PubChem CID:	74892257
Reduced:	NC4H4 (2)
Stoich.:	AB4C4 (2)
Weight, g/mol:	232.070703
ΔH_f, kcal/mol:	88.57
Dipole, Da:	2.48
IP(EA), eV:	-9.65(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-fluorophenoxy)phenyl]boronic acid

Drug info:

PubChemData

Smile

C#CC1=CN=CC(=C1)CN

DOS

IR

Vibrations