Geometry & MOs

Info

ID:	348458
PubChem CID:	127273559
Reduced:	SN3O3C18H29 (1)
Stoich.:	AB3C3D18E29 (1)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	-155.99
Dipole, Da:	3.84
IP(EA), eV:	-9.3(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-(4-methylpiperidin-1-yl)pyridine-3-carbonyl]-3-phenylpiperazin-2-one

Drug info:

PubChemData

Smile

CC(CC(=O)N1CSCC1C(=O)N2CCCC2)NC(=O)C3CCCC3

DOS

IR

Vibrations