Geometry & MOs

Info

ID:	24702
PubChem CID:	612343
Reduced:	OB2C15H28 (1)
Stoich.:	AB2C15D28 (1)
Weight, g/mol:	246.232626
ΔH_f, kcal/mol:	-167.81
Dipole, Da:	1.58
IP(EA), eV:	-9.21(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-diethyl-6-methyl-3-oxa-2,4-diboratricyclo[5.3.3.02,6]tridecane

Drug info:

PubChemData

Smile

B1(C(C2(B(O1)C3CCCC2CCC3)C)CC)CC

DOS

IR

Vibrations