Geometry & MOs

Info

ID:	333476
PubChem CID:	127252028
Reduced:	FON2H23C24 (1)
Stoich.:	ABC2D23E24 (1)
Weight, g/mol:	386.199428
ΔH_f, kcal/mol:	-20.4
Dipole, Da:	7.02
IP(EA), eV:	-9.22(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[6-(3-methoxyphenyl)pyridin-3-yl]piperidin-1-yl]-2-phenylethanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CN=C(C=C2)C3=CC(=CC=C3)F)C(=O)CC4=CC=CC=C4

DOS

IR

Vibrations