Geometry & MOs

Info

ID:	179365
PubChem CID:	76471201
Reduced:	Cl2F3O4H19C21 (1)
Stoich.:	A2B3C4D19E21 (1)
Weight, g/mol:	263.199762
ΔH_f, kcal/mol:	-308.52
Dipole, Da:	7.05
IP(EA), eV:	-9.87(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-aminobutyl)-4-(piperidin-1-ylmethyl)-3H-pyridin-2-one

Drug info:

PubChemData

Smile

COCOC1CCC2=C1C=CC(=C2)C(=O)CC(C3=CC(=CC(=C3)Cl)Cl)(C(F)(F)F)O

DOS

IR

Vibrations