Geometry & MOs

Info

ID:	22975
PubChem CID:	600472
Reduced:	BC12H21 (1)
Stoich.:	AB12C21 (1)
Weight, g/mol:	176.173631
ΔH_f, kcal/mol:	-56.32
Dipole, Da:	0.26
IP(EA), eV:	-9.33(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

13-boratricyclo[7.3.1.05,13]tridecane

Drug info:

PubChemData

Smile

B12C3CCCC1CCCC2CCC3

DOS

IR

Vibrations