Geometry & MOs

Info

ID:	138422
PubChem CID:	52365179
Reduced:	FON3C20H24 (1)
Stoich.:	ABC3D20E24 (1)
Weight, g/mol:	392.178573
ΔH_f, kcal/mol:	-30.38
Dipole, Da:	3.11
IP(EA), eV:	-9.12(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-(difluoromethoxy)-3-methoxy-N-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]benzamide

Drug info:

PubChemData

Smile

CN(CCCC1=CC(=NN1)C2=CC=C(C=C2)F)C(=O)[C@H]3CCC=CC3

DOS

IR

Vibrations