Geometry & MOs

Info

ID:	408772
PubChem CID:	135081540
Reduced:	BOC11H21 (1)
Stoich.:	ABC11D21 (1)
Weight, g/mol:	231.21583
ΔH_f, kcal/mol:	-101.24
Dipole, Da:	1.5
IP(EA), eV:	-9.76(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,7R)-N,N-di(propan-2-yl)-4-boratricyclo[5.2.1.02,6]dec-2(6)-en-4-amine

Drug info:

PubChemData

Smile

B1(CCC[C@H]1C(C)(C)C)OCC=C

DOS

IR

Vibrations