Geometry & MOs

Info

ID:	134112
PubChem CID:	51644920
Reduced:	ClFON3H17C19 (1)
Stoich.:	ABCD3E17F19 (1)
Weight, g/mol:	315.218487
ΔH_f, kcal/mol:	-23.32
Dipole, Da:	5.82
IP(EA), eV:	-8.93(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

7-methyl-2-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=NC=CN1CC2=CC=CC(=C2)CNC(=O)C3=C(C=CC=C3Cl)F

DOS

IR

Vibrations