Geometry & MOs

Info

ID:	83403
PubChem CID:	49857552
Reduced:	BClO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	282.099416
ΔH_f, kcal/mol:	-147.35
Dipole, Da:	3.95
IP(EA), eV:	-9.02(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-1-chloro-2-(4-fluorophenyl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)/C(=C\C2=CC=CC=C2)/Cl

DOS

IR

Vibrations