Geometry & MOs

Info

ID:	449619
PubChem CID:	135300099
Reduced:	ClN2F3C13H20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	212.188863
ΔH_f, kcal/mol:	-167.88
Dipole, Da:	5.02
IP(EA), eV:	-9.8(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,7-diazaspiro[3.5]nonan-2-yl)-2-methylbutan-1-ol

Drug info:

PubChemData

Smile

CCCCCCCCC1=C(N(N=C1C(F)(F)F)C)Cl

DOS

IR

Vibrations