Geometry & MOs

Info

ID:	234453
PubChem CID:	92298466
Reduced:	N2O4C15H20 (1)
Stoich.:	A2B4C15D20 (1)
Weight, g/mol:	281.118257
ΔH_f, kcal/mol:	-85.1
Dipole, Da:	7.07
IP(EA), eV:	-9.69(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chlorophenoxy)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H](CN(C1)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C

DOS

IR

Vibrations