Geometry & MOs

Info

ID:	399512
PubChem CID:	135040639
Reduced:	BClKF3C7H12 (1)
Stoich.:	ABCD3E7F12 (1)
Weight, g/mol:	199.067268
ΔH_f, kcal/mol:	-359.79
Dipole, Da:	9.81
IP(EA), eV:	-9.19(0.1)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

[(Z)-2-chlorohept-1-enyl]-trifluoroboranuide

Drug info:

PubChemData

Smile

[B-](/C=C(/CCCCC)\Cl)(F)(F)F.[K+]

DOS

IR

Vibrations