Geometry & MOs

Info

ID:	333424
PubChem CID:	127251976
Reduced:	ClN3C23H24 (1)
Stoich.:	AB3C23D24 (1)
Weight, g/mol:	370.204513
ΔH_f, kcal/mol:	62.41
Dipole, Da:	1.61
IP(EA), eV:	-8.95(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CN=C(C=C2)CC3=CC=CC=C3Cl)CC4=CC=CC=N4

DOS

IR

Vibrations