Geometry & MOs

Info

ID:	78479
PubChem CID:	49693228
Reduced:	FN2O3C21H23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	371.16452
ΔH_f, kcal/mol:	-132.4
Dipole, Da:	4.67
IP(EA), eV:	-9.24(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-fluorobenzoyl)piperidin-4-yl]methyl]-1-methyl-2-oxopyridine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C(=O)NCC2CCN(CC2)C(=O)C3=CC=CC=C3F

DOS

IR

Vibrations