Geometry & MOs

Info

ID:	413229
PubChem CID:	135086176
Reduced:	NO2F3C13H14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	326.24171
ΔH_f, kcal/mol:	-183.94
Dipole, Da:	2.66
IP(EA), eV:	-9.33(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-1-cyclohexyl-3-phenylprop-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

C/C(=C\C(=O)N(C)OC)/C1=CC=C(C=C1)C(F)(F)F

DOS

IR

Vibrations