Geometry & MOs

Info

ID:	373246
PubChem CID:	131312178
Reduced:	ClOF3N3H5C8 (1)
Stoich.:	ABC3D3E5F8 (1)
Weight, g/mol:	348.01938
ΔH_f, kcal/mol:	-147.61
Dipole, Da:	4.15
IP(EA), eV:	-9.69(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluoro-2-iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

C1=C(C(=C(C(=N1)C#N)N)CCl)OC(F)(F)F

DOS

IR

Vibrations