Geometry & MOs

Info

ID:	190850
PubChem CID:	78068562
Reduced:	NO2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	327.11567
ΔH_f, kcal/mol:	-125.91
Dipole, Da:	5.54
IP(EA), eV:	-9.37(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-butyl-3-[(2,6-dichlorophenyl)methyl]-2-methylpiperidin-4-one

Drug info:

PubChemData

Smile

CN(C(COCC1=CC=CC=C1)C(=O)O)C(=O)C(CC2=CC=CC=C2)N

DOS

IR

Vibrations