Geometry & MOs

Info

ID:	295891
PubChem CID:	117546531
Reduced:	NO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	261.136493
ΔH_f, kcal/mol:	-51.82
Dipole, Da:	4.55
IP(EA), eV:	-8.88(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(1,3-benzodioxol-5-yl)oxetan-3-yl]piperidine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2(COC2)C3CCCNC3

DOS

IR

Vibrations