Geometry & MOs

Info

ID:	264906
PubChem CID:	103502876
Reduced:	F2N3C15H15 (1)
Stoich.:	A2B3C15D15 (1)
Weight, g/mol:	233.189198
ΔH_f, kcal/mol:	-29.72
Dipole, Da:	4.74
IP(EA), eV:	-8.42(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-propan-2-ylpiperidin-1-yl)pyridin-4-yl]methanamine

Drug info:

PubChemData

Smile

CNCC1=C(C(=NC=C1)N2CCC3=C2C=C(C=C3)F)F

DOS

IR

Vibrations