Geometry & MOs

Info

ID:	83253
PubChem CID:	49857356
Reduced:	BClFO2C14H19 (1)
Stoich.:	ABCD2E14F19 (1)
Weight, g/mol:	230.124488
ΔH_f, kcal/mol:	-219.41
Dipole, Da:	2.84
IP(EA), eV:	-9.32(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-1-chloro-3-methylbut-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)CCC2=C(C=CC(=C2)F)Cl

DOS

IR

Vibrations