Geometry & MOs

Info

ID:	144933
PubChem CID:	53433654
Reduced:	BFO3C11H14 (1)
Stoich.:	ABC3D11E14 (1)
Weight, g/mol:	360.189675
ΔH_f, kcal/mol:	-235.25
Dipole, Da:	5.82
IP(EA), eV:	-8.76(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,6-trimethyl-2-(5-phenylmethoxynaphthalen-1-yl)-1,3,2-dioxaborinane

Drug info:

PubChemData

Smile

B1(OCC(CO1)(C)C)C2=C(C=CC(=C2)F)O

DOS

IR

Vibrations