Geometry & MOs

Info

ID:	59898
PubChem CID:	24902307
Reduced:	ClNOC13H18 (1)
Stoich.:	ABCD13E18 (1)
Weight, g/mol:	269.04153
ΔH_f, kcal/mol:	-41.94
Dipole, Da:	2.36
IP(EA), eV:	-8.71(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-bromo-2-methylphenoxy)piperidine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)OCC2CCNCC2

DOS

IR

Vibrations