Geometry & MOs

Info

ID:	282337
PubChem CID:	103922700
Reduced:	NOC13H27 (1)
Stoich.:	ABC13D27 (1)
Weight, g/mol:	225.209264
ΔH_f, kcal/mol:	-96.5
Dipole, Da:	3.34
IP(EA), eV:	-9.1(2.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[[(1S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]amino]butan-1-ol

Drug info:

PubChemData

Smile

CCCCC1CCCC1N[C@H](CC)CO

DOS

IR

Vibrations