Geometry & MOs

Info

ID:	295799
PubChem CID:	117544294
Reduced:	NOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-39.53
Dipole, Da:	3.4
IP(EA), eV:	-8.78(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-ethoxyphenyl)methyl]-6,6-dimethylpiperidin-3-one

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2CC(=O)CCC2(C)C

DOS

IR

Vibrations