Geometry & MOs

Info

ID:	179770
PubChem CID:	76529028
Reduced:	BFNO2C13H17 (1)
Stoich.:	ABCD2E13F17 (1)
Weight, g/mol:	267.124215
ΔH_f, kcal/mol:	-172.09
Dipole, Da:	5.41
IP(EA), eV:	-9.81(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-3-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]pyridine

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)C=CC2=C(C=NC=C2)F

DOS

IR

Vibrations