Geometry & MOs

Info

ID:	12658
PubChem CID:	142974
Reduced:	NOC10H12 (2)
Stoich.:	ABC10D12 (2)
Weight, g/mol:	324.183778
ΔH_f, kcal/mol:	-55.38
Dipole, Da:	3.13
IP(EA), eV:	-8.81(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dihydro-2H-pyridin-1-yl)-2-[2-[2-(3,4-dihydro-2H-pyridin-1-yl)-2-oxoethyl]phenyl]ethanone

Drug info:

PubChemData

Smile

C1CC=CN(C1)C(=O)CC2=CC=CC=C2CC(=O)N3CCCC=C3

DOS

IR

Vibrations