Geometry & MOs

Info

ID:	406214
PubChem CID:	135076897
Reduced:	SN2F3O3H5C10 (1)
Stoich.:	AB2C3D3E5F10 (1)
Weight, g/mol:	252.069947
ΔH_f, kcal/mol:	-209.03
Dipole, Da:	9.37
IP(EA), eV:	-10.26(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;trifluoro-[(E)-5-phenylpent-1-enyl]boranuide

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1C(F)(F)F)NC(=C(S2(=O)=O)C#N)O

DOS

IR

Vibrations