Geometry & MOs

Info

ID:	333425
PubChem CID:	127251977
Reduced:	ON2C25H26 (1)
Stoich.:	AB2C25D26 (1)
Weight, g/mol:	375.174691
ΔH_f, kcal/mol:	20.39
Dipole, Da:	5.55
IP(EA), eV:	-9.12(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[6-[(3-fluorophenyl)methyl]pyridin-3-yl]piperidin-1-yl]-pyridin-3-ylmethanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CN=C(C=C2)CC3=CC=CC=C3)C(=O)CC4=CC=CC=C4

DOS

IR

Vibrations