Geometry & MOs

Info

ID:	403634
PubChem CID:	135061082
Reduced:	BO4C15H29 (1)
Stoich.:	AB4C15D29 (1)
Weight, g/mol:	392.139119
ΔH_f, kcal/mol:	-303.98
Dipole, Da:	4.1
IP(EA), eV:	-10.26(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1,3,2-benzodioxaborol-2-yl)-1-naphthalen-1-ylethyl]-1,3,2-benzodioxaborole

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)[C@H](C)[C@H](C)C(=O)OCC(C)C

DOS

IR

Vibrations