Geometry & MOs

Info

ID:	340913
PubChem CID:	127263348
Reduced:	ClFN2O3C13H24 (1)
Stoich.:	ABC2D3E13F24 (1)
Weight, g/mol:	250.112487
ΔH_f, kcal/mol:	-242.41
Dipole, Da:	3.24
IP(EA), eV:	-9.07(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Drug info:

PubChemData

Smile

C1CNCCC1COC(=O)N2CCC(CC2)(CO)F.Cl

DOS

IR

Vibrations