Geometry & MOs

Info

ID:	403335
PubChem CID:	135059776
Reduced:	O2C4H9 (2)
Stoich.:	A2B4C9 (2)
Weight, g/mol:	202.189281
ΔH_f, kcal/mol:	-201.35
Dipole, Da:	2.01
IP(EA), eV:	-10.15(1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7-dimethyl-3-(2-methylprop-2-enyl)-3-borabicyclo[3.3.1]non-6-ene

Drug info:

PubChemData

Smile

CC[C@H]([C@@H](CCOCOC)O)O

DOS

IR

Vibrations