Geometry & MOs

Info

ID:	22443
PubChem CID:	597200
Reduced:	BNOC12H24 (1)
Stoich.:	ABCD12E24 (1)
Weight, g/mol:	209.195095
ΔH_f, kcal/mol:	-137.87
Dipole, Da:	3.03
IP(EA), eV:	-8.64(1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-2-propyl-1,3,2-oxazaborinane

Drug info:

PubChemData

Smile

B1(N(CCCO1)C2CCCCC2)CCC

DOS

IR

Vibrations