Geometry & MOs

Info

ID:	410765
PubChem CID:	135083566
Reduced:	BKF3H7C9 (1)
Stoich.:	ABC3D7E9 (1)
Weight, g/mol:	183.05929
ΔH_f, kcal/mol:	-264.51
Dipole, Da:	10.61
IP(EA), eV:	-8.69(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

trifluoro-[2-(2-methylphenyl)ethynyl]boranuide

Drug info:

PubChemData

Smile

[B-](C#CC1=CC=CC=C1C)(F)(F)F.[K+]

DOS

IR

Vibrations