Geometry & MOs

Info

ID:	21725
PubChem CID:	589656
Reduced:	BO5C12H15 (1)
Stoich.:	AB5C12D15 (1)
Weight, g/mol:	250.101254
ΔH_f, kcal/mol:	-251.17
Dipole, Da:	2.46
IP(EA), eV:	-9.51(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-3-phenyl-2,4,7-trioxa-3-borabicyclo[3.3.1]nonan-9-ol

Drug info:

PubChemData

Smile

B1(OC2COC(C(C2O)O1)OC)C3=CC=CC=C3

DOS

IR

Vibrations