Geometry & MOs

Info

ID:	399471
PubChem CID:	135040475
Reduced:	O2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	167.16072
ΔH_f, kcal/mol:	-112.08
Dipole, Da:	1.47
IP(EA), eV:	-9.23(0.64)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

9-methoxy-9-methyl-9-boranuidabicyclo[3.3.1]nonane

Drug info:

PubChemData

Smile

CC1=CCC(CC1)(C(C)CCO)C(=O)C

DOS

IR

Vibrations