Geometry & MOs

Info

ID:	341128
PubChem CID:	127263563
Reduced:	ClNF2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	249.153624
ΔH_f, kcal/mol:	-112.26
Dipole, Da:	4.41
IP(EA), eV:	-10.12(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,6-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one

Drug info:

PubChemData

Smile

C1C(CC1(C2=CC=C(C=C2)F)F)N.Cl

DOS

IR

Vibrations