Geometry & MOs

Info

ID:	295800
PubChem CID:	117544308
Reduced:	NO2C16H23 (1)
Stoich.:	AB2C16D23 (1)
Weight, g/mol:	261.136493
ΔH_f, kcal/mol:	-78.0
Dipole, Da:	4.03
IP(EA), eV:	-8.63(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzodioxol-5-ylmethyl)-6,6-dimethylpiperidin-3-one

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)CN2CC(=O)CCC2(C)C

DOS

IR

Vibrations