Geometry & MOs

Info

ID:	282713
PubChem CID:	103936866
Reduced:	FN2O3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	221.189198
ΔH_f, kcal/mol:	-173.79
Dipole, Da:	4.79
IP(EA), eV:	-9.65(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(1S)-1-aminopropyl]-N-butyl-N-methylpyridin-3-amine

Drug info:

PubChemData

Smile

CC(C1CCCN1C(=O)OC(C)(C)C)C(=O)C2=NC=C(C=C2)F

DOS

IR

Vibrations