Geometry & MOs

Info

ID:	20983
PubChem CID:	586600
Reduced:	BOC16H31 (1)
Stoich.:	ABC16D31 (1)
Weight, g/mol:	250.246796
ΔH_f, kcal/mol:	-143.77
Dipole, Da:	1.42
IP(EA), eV:	-9.15(1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-octoxy-9-borabicyclo[3.3.1]nonane

Drug info:

PubChemData

Smile

B1(C2CCCC1CCC2)OCCCCCCCC

DOS

IR

Vibrations