Geometry & MOs

Info

ID:	24148
PubChem CID:	608068
Reduced:	BF2O3C9H9 (1)
Stoich.:	AB2C3D9E9 (1)
Weight, g/mol:	214.061281
ΔH_f, kcal/mol:	-337.06
Dipole, Da:	7.51
IP(EA), eV:	-9.83(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-difluoroboranyloxy-4-methoxyphenyl)ethanone

Drug info:

PubChemData

Smile

B(OC1=C(C=CC(=C1)OC)C(=O)C)(F)F

DOS

IR

Vibrations